Glycoside
...
GD143154

Name:
1-{2,3,3a-trihydroxy-7-[(5-{[4-hydroxy-5-({5-[(5-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy]-4-methoxy-6-methyloxan-2-yl}oxy)-6-methyloxan-2-yl]oxy}-4-methoxy-6-methyloxan-2-yl)oxy]-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl}ethan-1-one

Formula:
C48H80O17

Smiles:
COC1CC(OC2C(C)OC(OC3C(O)CC(OC4C(C)OC(OC5CCC6(C)C(CCC7C6CCC6(C)C(C(C)=O)C(O)C(O)C76O)C5)CC4OC)OC3C)CC2OC)OC(C)C1O

Aglycone:
CC(=O)C1C(O)C(O)C2(O)C3CCC4CC(O)CCC4(C)C3CCC12C

Sugarmoiety:
COC1CC(OC2C(C)OC(OC3C(O)CC(OC4C(C)OC(O)CC4OC)OC3C)CC2OC)OC(C)C1O

Other Identifiers

Properties
HBA: 17 RingCount: 8
HBD: 5 FractionCSP3: 0.98
AlogP: 3.14 Num_rotatable_bonds: 12
MolWt: 929.15 Num_heavy_atoms: 65
TPSA: 219.75 NumAromaticRings: 0

Unique Aglycone
AD03430
Formula: C21H34O5

Smiles:
CC(=O)C1C(O)C(O)C2(O)C3CCC4CC(O)CCC4(C)C3CCC12C
HBA: 5 RingCount: 4
HBD: 4 FractionCSP3: 0.95
AlogP: 1.65 Num_rotatable_bonds: 1
MolWt: 366.5 Num_heavy_atoms: 26
TPSA: 97.99 NumAromaticRings: 0

Sugarmoiety
SD02879

COC1CC(OC2C(C)OC(OC3C(O)CC(OC4C(C)OC(O)CC4OC)OC3C)CC2OC)OC(C)C1O