Glycoside
...
GD116542

Name:
2-hydroxy-9a,11a-dimethyl-1-(6-methyl-5-methylideneheptan-2-yl)-7-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-4-yl acetate

Formula:
C36H58O8

Smiles:
C=C(CCC(C)C1C(O)CC2C3C(OC(C)=O)C=C4CC(OC5OC(C)C(O)C(O)C5O)CCC4(C)C3CCC21C)C(C)C

Aglycone:
C=C(CCC(C)C1C(O)CC2C3C(OC(C)=O)C=C4CC(O)CCC4(C)C3CCC21C)C(C)C

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

Other Identifiers

Properties
HBA: 8 RingCount: 5
HBD: 4 FractionCSP3: 0.86
AlogP: 4.92 Num_rotatable_bonds: 8
MolWt: 618.85 Num_heavy_atoms: 44
TPSA: 125.68 NumAromaticRings: 0

Unique Aglycone
AD46297
Formula: C30H48O4

Smiles:
C=C(CCC(C)C1C(O)CC2C3C(OC(C)=O)C=C4CC(O)CCC4(C)C3CCC21C)C(C)C
HBA: 4 RingCount: 4
HBD: 2 FractionCSP3: 0.83
AlogP: 6.07 Num_rotatable_bonds: 6
MolWt: 472.71 Num_heavy_atoms: 34
TPSA: 66.76 NumAromaticRings: 0

Sugarmoiety
SD00076

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