Glycoside
...
GD032392

Name:
None

Formula:
C47H74O16

Smiles:
CC=C(C)C(=O)O[C@@H]1C[C@H]2[C@]3(C)CC[C@@H](O[C@@H]4C[C@H](OC)[C@H](O[C@@H]5C[C@H](OC)[C@H](O[C@@H]6C[C@H](OC)[C@H](O)[C@H](C)O6)[C@H](C)O5)[C@H](C)O4)CC3=CC[C@]2(O)[C@]2(O)CC[C@](O)(C(C)=O)[C@]12C

Aglycone:
CC=C(C)C(=O)OC1CC2C3(C)CCC(O)CC3=CCC2(O)C2(O)CCC(O)(C(C)=O)C12C

Sugarmoiety:
COC1CC(OC2C(C)OC(OC3C(C)OC(O)CC3OC)CC2OC)OC(C)C1O

Other Identifiers

Properties
HBA: 16 RingCount: 7
HBD: 4 FractionCSP3: 0.87
AlogP: 3.95 Num_rotatable_bonds: 12
MolWt: 895.09 Num_heavy_atoms: 63
TPSA: 207.36 NumAromaticRings: 0

Unique Aglycone
AD20778
Formula: C26H38O7

Smiles:
CC=C(C)C(=O)OC1CC2C3(C)CCC(O)CC3=CCC2(O)C2(O)CCC(O)(C(C)=O)C12C
HBA: 7 RingCount: 4
HBD: 4 FractionCSP3: 0.77
AlogP: 2.35 Num_rotatable_bonds: 3
MolWt: 462.58 Num_heavy_atoms: 33
TPSA: 124.29 NumAromaticRings: 0

Sugarmoiety
SD00437

COC1CC(OC2C(C)OC(OC3C(C)OC(O)CC3OC)CC2OC)OC(C)C1O