Glycoside
GD146180
Name:
BacteriohopanehexolFormula:
C35H62O6Smiles:
CC(CCC(O)C(O)C(O)CO)C1CCC2(C)C1CCC1(C)C2CC(O)C2C3(C)CCCC(C)(C)C3C(O)CC21CAglycone:
CCC(C)C1CCC2(C)C1CCC1(C)C2CC(O)C2C3(C)CCCC(C)(C)C3C(O)CC21CSugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | 4.91 | Num_rotatable_bonds: | 7 |
| MolWt: | 578.88 | Num_heavy_atoms: | 41 |
| TPSA: | 121.38 | NumAromaticRings: | 0 |
Unique Aglycone
AD58628
Formula: C31H54O2
Smiles:
CCC(C)C1CCC2(C)C1CCC1(C)C2CC(O)C2C3(C)CCCC(C)(C)C3C(O)CC21C| HBA: | 2 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | 7.47 | Num_rotatable_bonds: | 2 |
| MolWt: | 458.77 | Num_heavy_atoms: | 33 |
| TPSA: | 40.46 | NumAromaticRings: | 0 |
