Glycoside
...
GD136584

Name:
2-[10-hydroxy-2-(1-methoxy-2-methyl-1-oxopropan-2-yl)-1,4a,4b,9,10-pentamethyl-6a-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}carbonyl)-1,2,3,4,4a,4b,5,6,6a,7,8,9,10,10a,12,12a-hexadecahydrochrysen-1-yl]acetic acid

Formula:
C37H58O12

Smiles:
COC(=O)C(C)(C)C1CCC2(C)C(CC=C3C4C(C(=O)OC5OC(CO)C(O)C(O)C5O)(CCC(C)C4(C)O)CCC32C)C1(C)CC(=O)O

Aglycone:
COC(=O)C(C)(C)C1CCC2(C)C(CC=C3C4C(C(=O)O)(CCC(C)C4(C)O)CCC32C)C1(C)CC(=O)O

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

Other Identifiers

Properties
HBA: 12 RingCount: 5
HBD: 6 FractionCSP3: 0.86
AlogP: 2.96 Num_rotatable_bonds: 7
MolWt: 694.86 Num_heavy_atoms: 49
TPSA: 200.28 NumAromaticRings: 0

Unique Aglycone
AD55216
Formula: C31H48O7

Smiles:
COC(=O)C(C)(C)C1CCC2(C)C(CC=C3C4C(C(=O)O)(CCC(C)C4(C)O)CCC32C)C1(C)CC(=O)O
HBA: 7 RingCount: 4
HBD: 3 FractionCSP3: 0.84
AlogP: 5.7 Num_rotatable_bonds: 5
MolWt: 532.72 Num_heavy_atoms: 38
TPSA: 121.13 NumAromaticRings: 0

Sugarmoiety
SD00003

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