Glycoside
...
GD035378

Name:
None

Formula:
C37H58O9

Smiles:
CCOC(=O)[C@@H]1O[C@H](O[C@@H]2CC[C@]3(C)[C@H](CC[C@]4(C)[C@H]3CC=C3[C@@H]5CC(C)(C)CC[C@@]5(O)C(=O)C[C@]34C)C2(C)C)[C@H](O)[C@H](O)[C@H]1O

Aglycone:
CC1(C)CCC2(O)C(=O)CC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1.CCOC=O

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 9 RingCount: 6
HBD: 4 FractionCSP3: 0.89
AlogP: 4.47 Num_rotatable_bonds: 4
MolWt: 646.86 Num_heavy_atoms: 46
TPSA: 142.75 NumAromaticRings: 0

Unique Aglycone
AD04485
Formula: C29H46O3

Smiles:
CC1(C)CCC2(O)C(=O)CC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1
HBA: 3 RingCount: 5
HBD: 2 FractionCSP3: 0.9
AlogP: 6.07 Num_rotatable_bonds: 0
MolWt: 442.68 Num_heavy_atoms: 32
TPSA: 57.53 NumAromaticRings: 0
AD10917
Formula: C3H6O2

Smiles:
CCOC=O
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.67
AlogP: 0.18 Num_rotatable_bonds: 2
MolWt: 74.08 Num_heavy_atoms: 5
TPSA: 26.3 NumAromaticRings: 0

Sugarmoiety
SD00017

OC1OC(O)C(O)C(O)C1O