Glycoside
...
GD128823

Name:
10-hydroxy-9-(hydroxymethyl)-1,2,6a,6b,9,12a-hexamethyl-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic acid

Formula:
C36H58O10

Smiles:
CC1C(OC2OC(CO)C(O)C(O)C2O)CC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(CO)C5CCC43C)C2C1C

Aglycone:
CC1C(O)CC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(CO)C5CCC43C)C2C1C

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 10 RingCount: 6
HBD: 7 FractionCSP3: 0.92
AlogP: 2.86 Num_rotatable_bonds: 5
MolWt: 650.85 Num_heavy_atoms: 46
TPSA: 177.14 NumAromaticRings: 0

Unique Aglycone
AD47149
Formula: C30H48O5

Smiles:
CC1C(O)CC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(CO)C5CCC43C)C2C1C
HBA: 5 RingCount: 5
HBD: 4 FractionCSP3: 0.9
AlogP: 5.03 Num_rotatable_bonds: 2
MolWt: 488.71 Num_heavy_atoms: 35
TPSA: 97.99 NumAromaticRings: 0

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O