Glycoside

GD155670
Name:
7-{5a,5b,8,8,11a,13b-hexamethyl-1H,2H,3H,3aH,4H,5H,5aH,5bH,7aH,8H,9H,10H,11H,11aH,11bH,13aH,13bH-cyclopenta[a]chrysen-3-yl}-1,2,3-tris(acetyloxy)octan-4-yl acetateFormula:
C43H66O8Smiles:
CC(=O)OCC(OC(C)=O)C(OC(C)=O)C(CCC(C)C1CCC2(C)C1CCC1(C)C2C=CC2C3(C)CCCC(C)(C)C3C=CC21C)OC(C)=OAglycone:
CCC(C)C1CCC2(C)C1CCC1(C)C2C=CC2C3(C)CCCC(C)(C)C3C=CC21CSugarmoiety:
CC(=O)OCC(OC(C)=O)C(OC(C)=O)C(O)OC(C)=OOther Identifiers
Properties
HBA: | 8 | RingCount: | 5 |
HBD: | 0 | FractionCSP3: | 0.81 |
AlogP: | 8.8 | Num_rotatable_bonds: | 11 |
MolWt: | 710.99 | Num_heavy_atoms: | 51 |
TPSA: | 105.2 | NumAromaticRings: | 0 |
Unique Aglycone
AD51261
Formula: C31H50
Smiles:
CCC(C)C1CCC2(C)C1CCC1(C)C2C=CC2C3(C)CCCC(C)(C)C3C=CC21CHBA: | 0 | RingCount: | 5 |
HBD: | 0 | FractionCSP3: | 0.87 |
AlogP: | 9.08 | Num_rotatable_bonds: | 2 |
MolWt: | 422.74 | Num_heavy_atoms: | 31 |
TPSA: | 0.0 | NumAromaticRings: | 0 |