Glycoside
GD035424
Name:
TETRAHYDROXYBACTERIOHOPANE GLUCOSAMINEFormula:
C41H73O8NSmiles:
C[C@H](CC[C@H](O)[C@H](O)[C@H](O)CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1N)[C@@H]1CC[C@]2(C)[C@H]1CC[C@]1(C)[C@H]2CC[C@@H]2[C@]3(C)CCCC(C)(C)[C@H]3CC[C@]21CAglycone:
CCC(C)C1CCC2(C)C1CCC1(C)C2CCC2C3(C)CCCC(C)(C)C3CCC21CSugarmoiety:
NC1C(OCC(O)C(O)C(O)O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 6 |
| HBD: | 8 | FractionCSP3: | 1.0 |
| AlogP: | 4.76 | Num_rotatable_bonds: | 10 |
| MolWt: | 708.03 | Num_heavy_atoms: | 50 |
| TPSA: | 165.86 | NumAromaticRings: | 0 |
Unique Aglycone
AD09499
Formula: C31H54
Smiles:
CCC(C)C1CCC2(C)C1CCC1(C)C2CCC2C3(C)CCCC(C)(C)C3CCC21C| HBA: | 0 | RingCount: | 5 |
| HBD: | 0 | FractionCSP3: | 1.0 |
| AlogP: | 9.52 | Num_rotatable_bonds: | 2 |
| MolWt: | 426.77 | Num_heavy_atoms: | 31 |
| TPSA: | 0.0 | NumAromaticRings: | 0 |
