Glycoside
...
GD148798

Name:
3-{3-[5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-6,9a,9b-trimethyl-7-(prop-1-en-2-yl)-4-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-dodecahydro-1H-cyclopenta[a]naphthalen-6-yl}propanoic acid

Formula:
C36H60O9

Smiles:
C=C(C)C1CCC2(C)C(CC(OC3OC(C)C(O)C(O)C3O)C3C(C4(C)CCC(C(C)(C)O)O4)CCC32C)C1(C)CCC(=O)O

Aglycone:
C=C(C)C1CCC2(C)C(CC(O)C3C(C4(C)CCC(C(C)(C)O)O4)CCC32C)C1(C)CCC(=O)O

Sugarmoiety:
CC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 9 RingCount: 5
HBD: 5 FractionCSP3: 0.92
AlogP: 4.82 Num_rotatable_bonds: 8
MolWt: 636.87 Num_heavy_atoms: 45
TPSA: 145.91 NumAromaticRings: 0

Unique Aglycone
AD59525
Formula: C30H50O5

Smiles:
C=C(C)C1CCC2(C)C(CC(O)C3C(C4(C)CCC(C(C)(C)O)O4)CCC32C)C1(C)CCC(=O)O
HBA: 5 RingCount: 4
HBD: 3 FractionCSP3: 0.9
AlogP: 5.97 Num_rotatable_bonds: 6
MolWt: 490.73 Num_heavy_atoms: 35
TPSA: 86.99 NumAromaticRings: 0

Sugarmoiety
SD00076

CC1OC(O)C(O)C(O)C1O