Glycoside
...
GD139174

Name:
2-({1-[4-(3,3-dimethyloxiran-2-yl)-4-hydroxybut-2-en-2-yl]-7,11-dihydroxy-3a,3b,6,6,9a-pentamethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-5-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triol

Formula:
C36H60O10

Smiles:
CC(=CC(O)C1OC1(C)C)C1CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3C(OC3OC(CO)C(O)C(O)C3O)CC12C

Aglycone:
CC(=CC(O)C1OC1(C)C)C1CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3C(O)CC12C

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

Other Identifiers

Properties
HBA: 10 RingCount: 6
HBD: 7 FractionCSP3: 0.94
AlogP: 2.28 Num_rotatable_bonds: 6
MolWt: 652.87 Num_heavy_atoms: 46
TPSA: 172.6 NumAromaticRings: 0

Unique Aglycone
AD56116
Formula: C30H50O5

Smiles:
CC(=CC(O)C1OC1(C)C)C1CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3C(O)CC12C
HBA: 5 RingCount: 5
HBD: 4 FractionCSP3: 0.93
AlogP: 4.46 Num_rotatable_bonds: 3
MolWt: 490.73 Num_heavy_atoms: 35
TPSA: 93.45 NumAromaticRings: 0

Sugarmoiety
SD00003

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