Glycoside
...
GD139596

Name:
6-hydroxy-7-[(5-{[5-({4-hydroxy-5-[(5-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy]-6-methyloxan-2-yl}oxy)-4-methoxy-6-methyloxan-2-yl]oxy}-4-methoxy-6-methyloxan-2-yl)oxy]-4b-methyl-2-(2-methylfuran-3-yl)-1,2,3,4,4a,4b,5,6,7,8,10,10a-dodecahydrophenanthren-1-one

Formula:
C47H72O16

Smiles:
COC1CC(OC2C(O)CC(OC3C(C)OC(OC4C(C)OC(OC5CC6=CCC7C(=O)C(c8ccoc8C)CCC7C6(C)CC5O)CC4OC)CC3OC)OC2C)OC(C)C1O

Aglycone:
Cc1occc1C1CCC2C(CC=C3CC(O)C(O)CC32C)C1=O

Sugarmoiety:
COC1CC(OC2C(O)CC(OC3C(C)OC(OC4C(C)OC(O)CC4OC)CC3OC)OC2C)OC(C)C1O

Other Identifiers

Properties
HBA: 16 RingCount: 8
HBD: 3 FractionCSP3: 0.85
AlogP: 4.61 Num_rotatable_bonds: 12
MolWt: 893.08 Num_heavy_atoms: 63
TPSA: 192.43 NumAromaticRings: 1

Unique Aglycone
AD46211
Formula: C20H26O4

Smiles:
Cc1occc1C1CCC2C(CC=C3CC(O)C(O)CC32C)C1=O
HBA: 4 RingCount: 4
HBD: 2 FractionCSP3: 0.65
AlogP: 3.12 Num_rotatable_bonds: 1
MolWt: 330.42 Num_heavy_atoms: 24
TPSA: 70.67 NumAromaticRings: 1

Sugarmoiety
SD04333

COC1CC(OC2C(O)CC(OC3C(C)OC(OC4C(C)OC(O)CC4OC)CC3OC)OC2C)OC(C)C1O