Glycoside
GD127035
Name:
Cephalezomine JFormula:
C23H27O9NSmiles:
O=C1CC23CCCN2CCc2cc4c(cc2C3=C1OC1OC(CO)C(O)C(O)C1O)OCO4Aglycone:
O=C1CC23CCCN2CCc2cc4c(cc2C3=C1O)OCO4Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.61 |
| AlogP: | -0.69 | Num_rotatable_bonds: | 3 |
| MolWt: | 461.47 | Num_heavy_atoms: | 33 |
| TPSA: | 138.15 | NumAromaticRings: | 1 |
Unique Aglycone
AD51424
Formula: C17H17O4N
Smiles:
O=C1CC23CCCN2CCc2cc4c(cc2C3=C1O)OCO4| HBA: | 5 | RingCount: | 5 |
| HBD: | 1 | FractionCSP3: | 0.47 |
| AlogP: | 2.05 | Num_rotatable_bonds: | 0 |
| MolWt: | 299.33 | Num_heavy_atoms: | 22 |
| TPSA: | 59.0 | NumAromaticRings: | 1 |
