Glycoside
...
GD147158

Name:
2-({[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-[(2-{7-[(3-{[4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]-11-hydroxy-1,3a,3b,6,6,9a-hexamethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl}-6-methylhept-4-en-2-yl)oxy]oxane-3,4,5-triol

Formula:
C59H100O26

Smiles:
CC(C)C=CCC(C)(OC1OC(COC2OC(CO)C(O)C2O)C(O)C(O)C1O)C1(C)CCC2(C)C1C(O)CC1C3(C)CCC(OC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4OC4OCC(O)C(O)C4O)C(C)(C)C3CCC12C

Aglycone:
CC(C)C=CCC(C)(O)C1(C)CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3CCC12C

Sugarmoiety:
OCC1OC(O)C(OC2OC(CO)C(O)C(O)C2OC2OCC(O)C(O)C2O)C(O)C1O.OCC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C1O

Other Identifiers

Properties
HBA: 26 RingCount: 9
HBD: 16 FractionCSP3: 0.97
AlogP: -2.85 Num_rotatable_bonds: 18
MolWt: 1225.42 Num_heavy_atoms: 85
TPSA: 415.98 NumAromaticRings: 0

Unique Aglycone
AD58945
Formula: C31H54O3

Smiles:
CC(C)C=CCC(C)(O)C1(C)CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3CCC12C
HBA: 3 RingCount: 4
HBD: 3 FractionCSP3: 0.94
AlogP: 6.75 Num_rotatable_bonds: 4
MolWt: 474.77 Num_heavy_atoms: 34
TPSA: 60.69 NumAromaticRings: 0

Sugarmoiety
SD05983

OCC1OC(O)C(OC2OC(CO)C(O)C(O)C2OC2OCC(O)C(O)C2O)C(O)C1O.OCC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C1O