Glycoside
...
GD035746

Name:
None

Formula:
C44H54O13

Smiles:
CC(C)=CCC[C@@]1(C)C=Cc2c(O)c3c(c(CC=C(C)C)c2O1)O[C@@]12C(=C[C@@H]4C[C@H]1C(C)(C)O[C@@]2(CC=C(C)C(=O)O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)C4=O)C3=O

Aglycone:
CC(C)=CCCC1(C)C=Cc2c(O)c3c(c(CC=C(C)C)c2O1)OC12C(=CC4CC1C(C)(C)OC2(CC=C(C)C(=O)O)C4=O)C3=O

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

Other Identifiers

Properties
HBA: 13 RingCount: 8
HBD: 5 FractionCSP3: 0.57
AlogP: 4.5 Num_rotatable_bonds: 10
MolWt: 790.9 Num_heavy_atoms: 57
TPSA: 198.51 NumAromaticRings: 1

Unique Aglycone
AD16203
Formula: C38H44O8

Smiles:
CC(C)=CCCC1(C)C=Cc2c(O)c3c(c(CC=C(C)C)c2O1)OC12C(=CC4CC1C(C)(C)OC2(CC=C(C)C(=O)O)C4=O)C3=O
HBA: 8 RingCount: 7
HBD: 2 FractionCSP3: 0.5
AlogP: 7.24 Num_rotatable_bonds: 8
MolWt: 628.76 Num_heavy_atoms: 46
TPSA: 119.36 NumAromaticRings: 1

Sugarmoiety
SD00003

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