Glycoside
...
GD145779

Name:
2-({[3,4-dihydroxy-6-(hydroxymethyl)-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}methyl)-6-{[9-hydroxy-8-(hydroxymethyl)-5a,5b,8,11a-tetramethyl-1-(prop-1-en-2-yl)-icosahydro-1H-cyclopenta[a]chrysen-3a-yl]oxy}oxane-3,4,5-triol

Formula:
C47H78O17

Smiles:
C=C(C)C1CCC2(OC3OC(COC4OC(CO)C(OC5OC(C)C(O)C(O)C5O)C(O)C4O)C(O)C(O)C3O)CCC3(C)C(CCC4C5(C)CCC(O)C(C)(CO)C5CCC43C)C12

Aglycone:
C=C(C)C1CCC2(O)CCC3(C)C(CCC4C5(C)CCC(O)C(C)(CO)C5CCC43C)C12

Sugarmoiety:
CC1OC(OC2C(CO)OC(OCC3OC(O)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 17 RingCount: 8
HBD: 11 FractionCSP3: 0.96
AlogP: 0.22 Num_rotatable_bonds: 10
MolWt: 915.12 Num_heavy_atoms: 64
TPSA: 277.91 NumAromaticRings: 0

Unique Aglycone
AD50171
Formula: C29H48O3

Smiles:
C=C(C)C1CCC2(O)CCC3(C)C(CCC4C5(C)CCC(O)C(C)(CO)C5CCC43C)C12
HBA: 3 RingCount: 5
HBD: 3 FractionCSP3: 0.93
AlogP: 5.72 Num_rotatable_bonds: 2
MolWt: 444.7 Num_heavy_atoms: 32
TPSA: 60.69 NumAromaticRings: 0

Sugarmoiety
SD00047

CC1OC(OC2C(CO)OC(OCC3OC(O)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O