Glycoside
...
GD005737

Name:
None

Formula:
C44H72O15

Smiles:
COC[C@H](O)C[C@@H]1O[C@](O)([C@H](O)[C@@H]2C[C@H](OC)[C@H](O)CCC=C(C)C=C[C@H](O[C@@H]3O[C@H](C)[C@H](OC)[C@H](O)[C@H]3O)[C@H](C)C=C(C)C=C(C)C=C(C)C(=O)O2)[C@H](C)[C@H](O)[C@H]1C

Aglycone:
COCC(O)CC1OC(O)(C(O)C2CC(OC)C(O)CCC=C(C)C=CC(O)C(C)C=C(C)C=C(C)C=C(C)C(=O)O2)C(C)C(O)C1C

Sugarmoiety:
COC1C(C)OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 15 RingCount: 3
HBD: 7 FractionCSP3: 0.75
AlogP: 2.78 Num_rotatable_bonds: 10
MolWt: 841.05 Num_heavy_atoms: 59
TPSA: 223.29 NumAromaticRings: 0

Unique Aglycone
AD02453
Formula: C37H60O11

Smiles:
COCC(O)CC1OC(O)(C(O)C2CC(OC)C(O)CCC=C(C)C=CC(O)C(C)C=C(C)C=C(C)C=C(C)C(=O)O2)C(C)C(O)C1C
HBA: 11 RingCount: 2
HBD: 6 FractionCSP3: 0.7
AlogP: 3.28 Num_rotatable_bonds: 7
MolWt: 680.88 Num_heavy_atoms: 48
TPSA: 175.37 NumAromaticRings: 0

Sugarmoiety
SD00158

COC1C(C)OC(O)C(O)C1O