Glycoside
GD129968
Name:
35-O-Α-Altruronopyranosylbacteriohopanetetrol 2Î’â€MethylFormula:
C42H72O10Smiles:
CC1CC(C)(C)C2CCC3(C)C(CCC4C5(C)CCC(C(C)CCC(O)C(O)C(O)COC6OC(C(=O)O)C(O)C(O)C6O)C5CCC43C)C2(C)C1Aglycone:
CCC(C)C1CCC2(C)C1CCC1(C)C2CCC2C3(C)CC(C)CC(C)(C)C3CCC21CSugarmoiety:
O=C(O)C1OC(OCC(O)C(O)C(O)O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 6 |
| HBD: | 7 | FractionCSP3: | 0.98 |
| AlogP: | 5.13 | Num_rotatable_bonds: | 10 |
| MolWt: | 737.03 | Num_heavy_atoms: | 52 |
| TPSA: | 177.14 | NumAromaticRings: | 0 |
Unique Aglycone
AD52658
Formula: C32H56
Smiles:
CCC(C)C1CCC2(C)C1CCC1(C)C2CCC2C3(C)CC(C)CC(C)(C)C3CCC21C| HBA: | 0 | RingCount: | 5 |
| HBD: | 0 | FractionCSP3: | 1.0 |
| AlogP: | 9.77 | Num_rotatable_bonds: | 2 |
| MolWt: | 440.8 | Num_heavy_atoms: | 32 |
| TPSA: | 0.0 | NumAromaticRings: | 0 |
