Glycoside
...
GD141057

Name:
3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl 9-formyl-1,10,11-trihydroxy-1,2,2,6a,6b,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylate

Formula:
C37H58O11

Smiles:
CC1(C=O)C(O)C(O)CC2(C)C1CCC1(C)C2CC=C2C3C(C(=O)OC4OC(CO)C(O)C(O)C4O)(CCC(C)(C)C3(C)O)CCC21C

Aglycone:
CC1(C=O)C(O)C(O)CC2(C)C1CCC1(C)C2CC=C2C3C(C(=O)O)(CCC(C)(C)C3(C)O)CCC21C

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

Other Identifiers

Properties
HBA: 11 RingCount: 6
HBD: 7 FractionCSP3: 0.89
AlogP: 2.0 Num_rotatable_bonds: 4
MolWt: 678.86 Num_heavy_atoms: 48
TPSA: 194.21 NumAromaticRings: 0

Unique Aglycone
AD56857
Formula: C31H48O6

Smiles:
CC1(C=O)C(O)C(O)CC2(C)C1CCC1(C)C2CC=C2C3C(C(=O)O)(CCC(C)(C)C3(C)O)CCC21C
HBA: 6 RingCount: 5
HBD: 4 FractionCSP3: 0.87
AlogP: 4.74 Num_rotatable_bonds: 2
MolWt: 516.72 Num_heavy_atoms: 37
TPSA: 115.06 NumAromaticRings: 0

Sugarmoiety
SD00003

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