Glycoside
GD119006
Name:
Rhizochalin BFormula:
C38H76O9N2Smiles:
CCCCOC(CCCCCCCCCCCCC(OC1OC(CO)C(O)C(O)C1O)C(C)N)CC(=O)CCCCCCCC(O)C(C)NAglycone:
CCCCOC(CCCCCCCCCCCCC(O)C(C)N)CC(=O)CCCCCCCC(O)C(C)NSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 1 |
| HBD: | 9 | FractionCSP3: | 0.97 |
| AlogP: | 4.78 | Num_rotatable_bonds: | 32 |
| MolWt: | 705.03 | Num_heavy_atoms: | 49 |
| TPSA: | 197.95 | NumAromaticRings: | 0 |
Unique Aglycone
AD47631
Formula: C32H66O4N2
Smiles:
CCCCOC(CCCCCCCCCCCCC(O)C(C)N)CC(=O)CCCCCCCC(O)C(C)N| HBA: | 6 | RingCount: | 0 |
| HBD: | 6 | FractionCSP3: | 0.97 |
| AlogP: | 6.96 | Num_rotatable_bonds: | 29 |
| MolWt: | 542.89 | Num_heavy_atoms: | 38 |
| TPSA: | 118.8 | NumAromaticRings: | 0 |
