Glycoside
GD126917
Name:
lanostane-3,25-diol; 3β-form, 3-o-[β-d-glucopyranosyl-(1->4)-β-d-glucopyranoside]Formula:
C42H74O12Smiles:
CC(CCCC(C)(C)O)C1CCC2(C)C3CCC4C(C)(C)C(OC5OC(CO)C(OC6OC(CO)C(O)C(O)C6O)C(O)C5O)CCC4(C)C3CCC12CAglycone:
CC(CCCC(C)(C)O)C1CCC2(C)C3CCC4C(C)(C)C(O)CCC4(C)C3CCC12CSugarmoiety:
OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 6 |
| HBD: | 8 | FractionCSP3: | 1.0 |
| AlogP: | 3.26 | Num_rotatable_bonds: | 11 |
| MolWt: | 771.04 | Num_heavy_atoms: | 54 |
| TPSA: | 198.76 | NumAromaticRings: | 0 |
Unique Aglycone
AD51374
Formula: C30H54O2
Smiles:
CC(CCCC(C)(C)O)C1CCC2(C)C3CCC4C(C)(C)C(O)CCC4(C)C3CCC12C| HBA: | 2 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | 7.61 | Num_rotatable_bonds: | 5 |
| MolWt: | 446.76 | Num_heavy_atoms: | 32 |
| TPSA: | 40.46 | NumAromaticRings: | 0 |
