Glycoside
...
GD132596

Name:
Astraverrucin V

Formula:
C44H72O15

Smiles:
CC(=O)OC1C(O)C(OC2CCC34CC35CCC3(C)C(C6(C)CCC(C(C)(C)O)O6)C(O)CC3(C)C5CC(O)C4C2(C)C)OC(CO)C1OC1OC(C)C(O)C(O)C1O

Aglycone:
CC(C)(O)C1CCC(C)(C2C(O)CC3(C)C4CC(O)C5C(C)(C)C(O)CCC56CC46CCC23C)O1

Sugarmoiety:
CC(=O)OC1C(O)C(O)OC(CO)C1OC1OC(C)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 15 RingCount: 8
HBD: 8 FractionCSP3: 0.98
AlogP: 1.68 Num_rotatable_bonds: 8
MolWt: 841.05 Num_heavy_atoms: 59
TPSA: 234.29 NumAromaticRings: 0

Unique Aglycone
AD04921
Formula: C30H50O5

Smiles:
CC(C)(O)C1CCC(C)(C2C(O)CC3(C)C4CC(O)C5C(C)(C)C(O)CCC56CC46CCC23C)O1
HBA: 5 RingCount: 6
HBD: 4 FractionCSP3: 1.0
AlogP: 4.44 Num_rotatable_bonds: 2
MolWt: 490.73 Num_heavy_atoms: 35
TPSA: 90.15 NumAromaticRings: 0

Sugarmoiety
SD07535

CC(=O)OC1C(O)C(O)OC(CO)C1OC1OC(C)C(O)C(O)C1O