Glycoside
...
GD022834

Name:
2-{[3a-hydroxy-9a,11a-dimethyl-1-(5-oxo-2,5-dihydrofuran-3-yl)-hexadecahydro-1H-cyclopenta[a]phenanthren-7-yl]oxy}-4-methoxy-6-methyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-3-yl acetate

Formula:
C38H58O14

Smiles:
CO[C@H]1[C@H](OC(C)=O)[C@@H](O[C@@H]2CC[C@@]3(C)[C@@H](CC[C@H]4[C@H]3CC[C@]3(C)[C@H](C5=CC(=O)OC5)CC[C@@]43O)C2)O[C@@H](C)[C@H]1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O

Aglycone:
CC12CCC(O)CC1CCC1C2CCC2(C)C(C3=CC(=O)OC3)CCC12O

Sugarmoiety:
COC1C(OC2OC(CO)C(O)C(O)C2O)C(C)OC(O)C1OC(C)=O

Other Identifiers

Properties
HBA: 14 RingCount: 7
HBD: 5 FractionCSP3: 0.89
AlogP: 1.51 Num_rotatable_bonds: 8
MolWt: 738.87 Num_heavy_atoms: 52
TPSA: 199.9 NumAromaticRings: 0

Unique Aglycone
AD01378
Formula: C23H34O4

Smiles:
CC12CCC(O)CC1CCC1C2CCC2(C)C(C3=CC(=O)OC3)CCC12O
HBA: 4 RingCount: 5
HBD: 2 FractionCSP3: 0.87
AlogP: 3.6 Num_rotatable_bonds: 1
MolWt: 374.52 Num_heavy_atoms: 27
TPSA: 66.76 NumAromaticRings: 0

Sugarmoiety
SD00403

COC1C(OC2OC(CO)C(O)C(O)C2O)C(C)OC(O)C1OC(C)=O