Glycoside
...
GD138590

Name:
7-hydroxy-3a,6,6,11a-tetramethyl-1-(6-methylhepta-4,6-dien-2-yl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-9b-carbaldehyde

Formula:
C36H56O8

Smiles:
C=C(C)C=CCC(C)C1CCC2(C)C3C(OC4OC(CO)C(O)C(O)C4O)C=C4C(CCC(O)C4(C)C)C3(C=O)CCC12C

Aglycone:
C=C(C)C=CCC(C)C1CCC2(C)C3C(O)C=C4C(CCC(O)C4(C)C)C3(C=O)CCC12C

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 8 RingCount: 5
HBD: 5 FractionCSP3: 0.81
AlogP: 4.09 Num_rotatable_bonds: 8
MolWt: 616.84 Num_heavy_atoms: 44
TPSA: 136.68 NumAromaticRings: 0

Unique Aglycone
AD55927
Formula: C30H46O3

Smiles:
C=C(C)C=CCC(C)C1CCC2(C)C3C(O)C=C4C(CCC(O)C4(C)C)C3(C=O)CCC12C
HBA: 3 RingCount: 4
HBD: 2 FractionCSP3: 0.77
AlogP: 6.26 Num_rotatable_bonds: 5
MolWt: 454.7 Num_heavy_atoms: 33
TPSA: 57.53 NumAromaticRings: 0

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O