Glycoside
...
GD132772

Name:
3-(10,14-dimethyl-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-18,21-dioxahexacyclo[12.9.0.0²,¹¹.0⁵,¹⁰.0¹⁵,²².0¹⁶,²⁰]tricosa-1(23),2(11)-dien-19-yl)-3-hydroxy-4-methylpentan-2-one

Formula:
C35H52O10

Smiles:
CC(=O)C(O)(C(C)C)C1OCC2C1OC1C=C3C4=C(CCC3(C)C12)C1(C)CCC(OC2OC(CO)C(O)C(O)C2O)CC1CC4

Aglycone:
CC(=O)C(O)(C(C)C)C1OCC2C1OC1C=C3C4=C(CCC3(C)C12)C1(C)CCC(O)CC1CC4

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

Other Identifiers

Properties
HBA: 10 RingCount: 7
HBD: 5 FractionCSP3: 0.86
AlogP: 2.18 Num_rotatable_bonds: 6
MolWt: 632.79 Num_heavy_atoms: 45
TPSA: 155.14 NumAromaticRings: 0

Unique Aglycone
AD53753
Formula: C29H42O5

Smiles:
CC(=O)C(O)(C(C)C)C1OCC2C1OC1C=C3C4=C(CCC3(C)C12)C1(C)CCC(O)CC1CC4
HBA: 5 RingCount: 6
HBD: 2 FractionCSP3: 0.83
AlogP: 4.36 Num_rotatable_bonds: 3
MolWt: 470.65 Num_heavy_atoms: 34
TPSA: 75.99 NumAromaticRings: 0

Sugarmoiety
SD00003

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