AZUCARES, VITAMINAS, ESTEROIDES, ALCALOIDES. MINOACIDOS ESENCIALES

1. AZUCARES
Molecular Formula = C6 H12 O6
Formula Weight = 180.156
Composition = C(40.00%) H(6.71%)
O(53.29%)
Molar Refractivity = 37.25 ± 0.3 cm3
Molar Volume = 104.0 ± 3.0 cm3
Parachor = 312.7 ± 4.0 cm3
Index of Refraction = 1.635 ± 0.02
Surface Tension = 81.7 ± 3.0
dyne/cm
Density = 1.732 ± 0.06 g/cm3
Dielectric Constant = Not available
Polarizability = 14.76 ± 0.5 10-24cm3
Monoisotopic Mass = 180.06339 Da
Nominal Mass = 180 Da
Average Mass = 180.157763 Da
O
H
H
H
OH
H
OH
H OH
OH
OH
-D-Galactopyranose
O OH
H
OH
OH
H
H
OH
OH
-D-Fructofuranose
Molecular Formula = C12 H24 O12
Formula Weight = 360.312
Composition = C(40.00%) H(6.71%)
O(53.29%)
Molar Refractivity = Not available
Molar Volume = Not available
Parachor = Not available
Index of Refraction = Not available
Surface Tension = Not available
Density = Not available
Dielectric Constant = Not available
Polarizability = Not available
Monoisotopic Mass = 360.12678 Da
Nominal Mass = 360 Da
Average Mass = 360.315527 Da
O
OH
OH
H
H
OH
H
OH OH
-D-Sorbofuranose
Molecular Formula = C18 H36 O18
Formula Weight = 540.468
Composition = C(40.00%) H(6.71%)
O(53.29%)
Molar Refractivity = Not available
Molar Volume = Not available
Parachor = Not available
Index of Refraction = Not available
Surface Tension = Not available
Density = Not available
Dielectric Constant = Not available
Polarizability = Not available
Monoisotopic Mass = 540.19017 Da
Nominal Mass = 540 Da
Average Mass = 540.47329 Da
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2. VITAMINAS
O H
OH
OH
HH
OH
H
OH
OH
-D-Mannofuranose
Molecular Formula = C24 H48 O24
Formula Weight = 720.624
Composition = C(40.00%) H(6.71%)
O(53.29%)
Molar Refractivity = Not available
Molar Volume = Not available
Parachor = Not available
Index of Refraction = Not available
Surface Tension = Not available
Density = Not available
Dielectric Constant = Not available
Polarizability = Not available
Monoisotopic Mass = 720.25356 Da
Nominal Mass = 720 Da
Average Mass = 720.631053 Da
O
H
OH
H
OHH
OH
H
OH
OH
-D-Glucofuranose
Molecular Formula = C30 H60 O30
Formula Weight = 900.779
Composition = C(40.00%) H(6.71%)
O(53.29%)
Molar Refractivity = Not available
Molar Volume = Not available
Parachor = Not available
Index of Refraction = Not available
Surface Tension = Not available
Density = Not available
Dielectric Constant = Not available
Polarizability = Not available
Monoisotopic Mass = 900.31695 Da
Nominal Mass = 900 Da
Average Mass = 900.788816 Da
OH
CH3
CH3CH3
CH3 CH3
VitaminA Retinol
Molecular Formula = C20 H30 O
Formula Weight = 286.452
Composition = C(83.86%) H(10.56%)
O(5.59%)
Molar Refractivity = 95.49 ± 0.3 cm3
Molar Volume = 300.0 ± 3.0 cm3
Parachor = 738.0 ± 6.0 cm3
Index of Refraction = 1.549 ± 0.02
Surface Tension = 36.6 ± 3.0 dyne/cm
Density = 0.954 ± 0.06 g/cm3
Dielectric Constant = Not available
Polarizability = 37.85 ± 0.5 10-24cm3
Monoisotopic Mass = 286.229665 Da
Nominal Mass = 286 Da
Average Mass = 286.459321 Da
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3. N
O
NH2
Vitamin B3 Niacinamide
Molecular Formula = C26 H36 N2 O2
Formula Weight = 408.576
Composition = C(76.43%) H(8.88%)
N(6.86%) O(7.83%)
Molar Refractivity = Not available
Molar Volume = Not available
Parachor = Not available
Index of Refraction = Not available
Surface Tension = Not available
Density = Not available
Dielectric Constant = Not available
Polarizability = Not available
Monoisotopic Mass = 408.277678 Da
Nominal Mass = 408 Da
Average Mass = 408.58615 Da
N
N
NH2
CH3
N
+
S
CH3
OH
Cl
-
Thiaminechloride
VitaminB1
Molecular Formula = C26 H36 N2 O2
Formula Weight = 408.576
Composition = C(76.43%) H(8.88%)
N(6.86%) O(7.83%)
Molar Refractivity = Not available
Molar Volume = Not available
Parachor = Not available
Index of Refraction = Not available
Surface Tension = Not available
Density = Not available
Dielectric Constant = Not available
Polarizability = Not available
Monoisotopic Mass = 408.277678 Da
Nominal Mass = 408 Da
Average Mass = 408.58615 Da
N N
N
N H
O
O
OH
OH
OH
OH
CH 3
CH 3
H
H
H
HH
V i t a m i n B2 R i b o f l a v i n
Molecular Formula = C43 H56 N6 O8
Formula Weight = 784.940
Composition = C(65.80%) H(7.19%)
N(10.71%) O(16.31%)
Molar Refractivity = Not available
Molar Volume = Not available
Parachor = Not available
Index of Refraction = Not available
Surface Tension = Not available
Density = Not available
Dielectric Constant = Not available
Polarizability = Not available
Monoisotopic Mass = 784.415964 Da
Nominal Mass = 784 Da
Average Mass = 784.956019 Da
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4. ESTEROIDES
N
N
H
N
N
NH2
Vitamin B4 Adenine
Molecular Formula = C28 H31 N11 O7
Formula Weight = 633.616
Composition = C(53.08%) H(4.93%)
N(24.32%) O(17.68%)
Molar Refractivity = Not available
Molar Volume = Not available
Parachor = Not available
Index of Refraction = Not available
Surface Tension = Not available
Density = Not available
Dielectric Constant = Not available
Polarizability = Not available
Monoisotopic Mass = 633.240794 Da
Nominal Mass = 633 Da
Average Mass = 633.625378 Da
Molecular Formula = C17 H28
Formula Weight = 232.404
Composition = C(87.86%) H(12.14%)
Molar Refractivity = 72.55 ± 0.3 cm3
Molar Volume = 244.6 ± 3.0 cm3
Parachor = 586.8 ± 4.0 cm3
Index of Refraction = 1.504 ± 0.02
Surface Tension = 33.1 ± 3.0 dyne/cm
Density = 0.949 ± 0.06 g/cm3
Dielectric Constant = 2.19 ± 0.1
Polarizability = 28.76 ± 0.5 10-24cm3
Monoisotopic Mass = 232.2191 Da
Nominal Mass = 232 Da
Average Mass = 232.410954 Da
13
149
810
17
12
11
15
16
75
6
H
H
1
4
2
3
H
H
H
Gonane
13
149
810
17
12
11
15
16
75
6
20
CH3
18
CH3
19
1
23
22
4
CH3
21
24
2
3
H
H
H
H
25
CH3
28
CH326
CH327
Ergostane
Molecular Formula = C72 H126
Formula Weight = 991.771
Composition = C(87.19%) H(12.81%)
Molar Refractivity = Not available
Molar Volume = Not available
Parachor = Not available
Index of Refraction = Not available
Surface Tension = Not available
Density = Not available
Dielectric Constant = Not available
Polarizability = Not available
Monoisotopic Mass = 990.98595 Da
Nominal Mass = 990 Da
Average Mass = 991.799626 Da
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5. ALCALOIDES
13
149
810
17
12
11
15
16
75
6
20
CH3
18
CH3
19
1
23
22
4
CH3
21
24
2
3
H
H
H
H
25
CH327
CH3
26
Cholestane
Molecular Formula = C44 H76
Formula Weight = 605.074
Composition = C(87.34%) H(12.66%)
Molar Refractivity = Not available
Molar Volume = Not available
Parachor = Not available
Index of Refraction = Not available
Surface Tension = Not available
Density = Not available
Dielectric Constant = Not available
Polarizability = Not available
Monoisotopic Mass = 604.5947 Da
Nominal Mass = 604 Da
Average Mass = 605.091795 Da
O 17
3
2
16
O
15 4
181
24 14
1312
11
6
19
N
5
23 7
8
9
10OH
CH3
25
O
22
O
20
21
H
H
chelidonine
Molecular Formula = C20 H19 N O5
Formula Weight = 353.369
Composition = C(67.98%) H(5.42%)
N(3.96%) O(22.64%)
Molar Refractivity = 92.48 ± 0.3 cm3
Molar Volume = 248.4 ± 3.0 cm3
Parachor = 687.8 ± 6.0 cm3
Index of Refraction = 1.667 ± 0.02
Surface Tension = 58.7 ± 3.0 dyne/cm
Density = 1.422 ± 0.06 g/cm3
Dielectric Constant = Not available
Polarizability = 36.66 ± 0.5 10-24cm3
Monoisotopic Mass = 353.126324 Da
Nominal Mass = 353 Da
Average Mass = 353.37553 Da
8
13
9
12
10
11
7
N
H
1
2
5
N
4
6
3 21
20
15
14
16
CH317
19
CH318
H
corynan
Molecular Formula = C39 H45 N3 O5
Formula Weight = 635.792
Composition = C(73.67%) H(7.13%)
N(6.61%) O(12.58%)
Molar Refractivity = Not available
Molar Volume = Not available
Parachor = Not available
Index of Refraction = Not available
Surface Tension = Not available
Density = Not available
Dielectric Constant = Not available
Polarizability = Not available
Monoisotopic Mass = 635.335922 Da
Nominal Mass = 635 Da
Average Mass = 635.806052 Da
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6. AMINOACIDOS ESENCIALES
18
14
10
7
9
8
13
N
5
19
6
4
31
2
11
12
O
15
O
17
16
H
crinan
Molecular Formula = C55 H64 N4 O7
Formula Weight = 893.119
Composition = C(73.96%) H(7.22%)
N(6.27%) O(12.54%)
Molar Refractivity = Not available
Molar Volume = Not available
Parachor = Not available
Index of Refraction = Not available
Surface Tension = Not available
Density = Not available
Dielectric Constant = Not available
Polarizability = Not available
Monoisotopic Mass = 892.477501 Da
Nominal Mass = 892 Da
Average Mass = 893.139518 Da
O
N H 2
CH 3 O H
A lan in e (A la)
Molecular Formula = C3 H7 N O2
Formula Weight = 89.093
Composition = C(40.44%) H(7.92%)
N(15.72%) O(35.92%)
Molar Refractivity = 21.00 ± 0.3 cm3
Molar Volume = 76.7 ± 3.0 cm3
Parachor = 199.7 ± 4.0 cm3
Index of Refraction = 1.459 ± 0.02
Surface Tension = 45.8 ± 3.0 dyne/cm
Density = 1.161 ± 0.06 g/cm3
Dielectric Constant = Not available
Polarizability = 8.32 ± 0.5 10-24cm3
Monoisotopic Mass = 89.047679 Da
Nominal Mass = 89 Da
Average Mass = 89.094276 Da
O
N H 2
O HCH 3
A m inobutyric
A cid (A bu)
Molecular Formula = C7 H16 N2 O4
Formula Weight = 192.213
Composition = C(43.74%) H(8.39%)
N(14.57%) O(33.30%)
Molar Refractivity = Not available
Molar Volume = Not available
Parachor = Not available
Index of Refraction = Not available
Surface Tension = Not available
Density = Not available
Dielectric Constant = Not available
Polarizability = Not available
Monoisotopic Mass = 192.111008 Da
Nominal Mass = 192 Da
Average Mass = 192.21554 Da
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7. NH
O
NH
NH2
NH2
OH
Arginine(Arg)
Molecular Formula = C13 H30 N6 O6
Formula Weight = 366.414
Composition = C(42.61%) H(8.25%) N(22.94%)
O(26.20%)
Molar Refractivity = Not available
Molar Volume = Not available
Parachor = Not available
Index of Refraction = Not available
Surface Tension = Not available
Density = Not available
Dielectric Constant = Not available
Polarizability = Not available
Monoisotopic Mass = 366.222684 Da
Nominal Mass = 366 Da
Average Mass = 366.418927 Da
O
O
NH2
NH2
OH
Asparagine (Asn)
Molecular Formula = C13 H30 N6 O6
Formula Weight = 366.414
Composition = C(42.61%) H(8.25%) N(22.94%)
O(26.20%)
Molar Refractivity = Not available
Molar Volume = Not available
Parachor = Not available
Index of Refraction = Not available
Surface Tension = Not available
Density = Not available
Dielectric Constant = Not available
Polarizability = Not available
Monoisotopic Mass = 366.222684 Da
Nominal Mass = 366 Da
Average Mass = 366.418927 Da
O
O
NH2
NH2
OH
Asparagine(Asn)
Molecular Formula = C17 H38 N8 O9
Formula Weight = 498.532
Composition = C(40.96%) H(7.68%)
N(22.48%) O(28.88%)
Molar Refractivity = Not available
Molar Volume = Not available
Parachor = Not available
Index of Refraction = Not available
Surface Tension = Not available
Density = Not available
Dielectric Constant = Not available
Polarizability = Not available
Monoisotopic Mass = 498.276177 Da
Nominal Mass = 498 Da
Average Mass = 498.538244 Da
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8. OH
OH
NH2O
O
Aspartic
Acid (Asp)
Molecular Formula = C4 H7 N O4
Formula Weight = 133.103
Composition = C(36.09%) H(5.30%)
N(10.52%) O(48.08%)
Molar Refractivity = 27.20 ± 0.3 cm3
Molar Volume = 87.8 ± 3.0 cm3
Parachor = 261.3 ± 4.0 cm3
Index of Refraction = 1.531 ± 0.02
Surface Tension = 78.2 ± 3.0 dyne/cm
Density = 1.514 ± 0.06 g/cm3
Dielectric Constant = Not available
Polarizability = 10.78 ± 0.5 10-24cm3
Monoisotopic Mass = 133.037509 Da
Nominal Mass = 133 Da
Average Mass = 133.103923 Da
O
NH2
SH OH
Cysteine (Cys)
Molecular Formula = C7 H14 N2 O6 S
Formula Weight = 254.262
Composition = C(33.07%) H(5.55%)
N(11.02%) O(37.75%) S(12.61%)
Molar Refractivity = Not available
Molar Volume = Not available
Parachor = Not available
Index of Refraction = Not available
Surface Tension = Not available
Density = Not available
Dielectric Constant = Not available
Polarizability = Not available
Monoisotopic Mass = 254.057259 Da
Nominal Mass = 254 Da
Average Mass = 254.262587 Da
O O
OHOH
NH2
Glutamic
Acid (Glu)
Molecular Formula = C17 H32 N4 O14 S
Formula Weight = 548.521
Composition = C(37.22%) H(5.88%)
N(10.21%) O(40.84%) S(5.85%)
Molar Refractivity = Not available
Molar Volume = Not available
Parachor = Not available
Index of Refraction = Not available
Surface Tension = Not available
Density = Not available
Dielectric Constant = Not available
Polarizability = Not available
Monoisotopic Mass = 548.163577 Da
Nominal Mass = 548 Da
Average Mass = 548.52441 Da
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