Glycoside
GD009361
Name:
SIBIROMYCINFormula:
C24H33O7N3Smiles:
CC=CC1=CN2C(=O)c3cc(O[C@@H]4O[C@H](C)[C@H](NC)[C@@](C)(O)[C@H]4O)c(C)c(O)c3N[C@H](O)[C@H]2C1Aglycone:
CC=CC1=CN2C(=O)c3cc(O)c(C)c(O)c3NC(O)C2C1Sugarmoiety:
CNC1C(C)OC(O)C(O)C1(C)OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.54 |
| AlogP: | 0.94 | Num_rotatable_bonds: | 4 |
| MolWt: | 475.54 | Num_heavy_atoms: | 34 |
| TPSA: | 143.75 | NumAromaticRings: | 1 |
Unique Aglycone
AD07344
Formula: C16H18O4N2
Smiles:
CC=CC1=CN2C(=O)c3cc(O)c(C)c(O)c3NC(O)C2C1| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.31 |
| AlogP: | 1.82 | Num_rotatable_bonds: | 1 |
| MolWt: | 302.33 | Num_heavy_atoms: | 22 |
| TPSA: | 93.03 | NumAromaticRings: | 1 |
