Glycoside
GD145754
Name:
7-{5a,5b,8,8,9,11a,13b-heptamethyl-1H,2H,3H,3aH,4H,5H,5aH,5bH,7aH,8H,9H,10H,11H,11aH,11bH,13aH,13bH-cyclopenta[a]chrysen-3-yl}octane-1,2,3,4,5-pentolFormula:
C36H60O5Smiles:
CC(CC(O)C(O)C(O)C(O)CO)C1CCC2(C)C1CCC1(C)C2C=CC2C3(C)CCC(C)C(C)(C)C3C=CC21CAglycone:
CC(C)C1CCC2(C)C1CCC1(C)C2C=CC2C3(C)CCC(C)C(C)(C)C3C=CC21CSugarmoiety:
OCC(O)C(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.89 |
| AlogP: | 5.74 | Num_rotatable_bonds: | 7 |
| MolWt: | 572.87 | Num_heavy_atoms: | 41 |
| TPSA: | 101.15 | NumAromaticRings: | 0 |
Unique Aglycone
AD58486
Formula: C31H50
Smiles:
CC(C)C1CCC2(C)C1CCC1(C)C2C=CC2C3(C)CCC(C)C(C)(C)C3C=CC21C| HBA: | 0 | RingCount: | 5 |
| HBD: | 0 | FractionCSP3: | 0.87 |
| AlogP: | 8.93 | Num_rotatable_bonds: | 1 |
| MolWt: | 422.74 | Num_heavy_atoms: | 31 |
| TPSA: | 0.0 | NumAromaticRings: | 0 |
