Glycoside
...
GD132267

Name:
2-({6-[(6-{[6-({6-[(6-{[3a,11-dihydroxy-1-(1-hydroxyethyl)-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-yl]oxy}-4-methoxy-2-methyloxan-3-yl)oxy]-4-methoxy-2-methyloxan-3-yl}oxy)-4-methoxy-2-methyloxan-3-yl]oxy}-4-methoxy-2-methyloxan-3-yl)oxy]-4-methoxy-2-methyloxan-3-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triol

Formula:
C62H104O24

Smiles:
COC1CC(OC2CCC3(C)C(=CCC4C3CC(O)C3(C)C(C(C)O)CCC43O)C2)OC(C)C1OC1CC(OC)C(OC2CC(OC)C(OC3CC(OC)C(OC4CC(OC)C(OC5OC(CO)C(O)C(O)C5O)C(C)O4)C(C)O3)C(C)O2)C(C)O1

Aglycone:
CC(O)C1CCC2(O)C3CC=C4CC(O)CCC4(C)C3CC(O)C12C

Sugarmoiety:
COC1CC(O)OC(C)C1OC1CC(OC)C(OC2CC(OC)C(OC3CC(OC)C(OC4CC(OC)C(OC5OC(CO)C(O)C(O)C5O)C(C)O4)C(C)O3)C(C)O2)C(C)O1

Other Identifiers

Properties
HBA: 24 RingCount: 10
HBD: 7 FractionCSP3: 0.97
AlogP: 2.89 Num_rotatable_bonds: 19
MolWt: 1233.49 Num_heavy_atoms: 86
TPSA: 298.52 NumAromaticRings: 0

Unique Aglycone
AD49938
Formula: C21H34O4

Smiles:
CC(O)C1CCC2(O)C3CC=C4CC(O)CCC4(C)C3CC(O)C12C
HBA: 4 RingCount: 4
HBD: 4 FractionCSP3: 0.9
AlogP: 2.39 Num_rotatable_bonds: 1
MolWt: 350.5 Num_heavy_atoms: 25
TPSA: 80.92 NumAromaticRings: 0

Sugarmoiety
SD04457

COC1CC(O)OC(C)C1OC1CC(OC)C(OC2CC(OC)C(OC3CC(OC)C(OC4CC(OC)C(OC5OC(CO)C(O)C(O)C5O)C(C)O4)C(C)O3)C(C)O2)C(C)O1