Manumycin B
HIT217707477
sdf文件结构编辑类似物检索
HIT ID: HIT217707477
Cas No: 139023-58-8
分子式: C28H34N2O7
分子量: 510.587
常用名: Manumycin B
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (2E,4R)-N-[(1S,5S,6R)-5-hydroxy-5-[(1E,3E,5E)-6-[(2-hydroxy-5-oxocyclopent-1-en-1-yl)carbamoyl]hexa-1,3,5-trien-1-yl]-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]-2,4-dimethyloct-2-enamide
IUPAC: (2E,4R)-N-[(1S,5S,6R)-5-hydroxy-5-[(1E,3E,5E)-6-[(2-hydroxy-5-oxocyclopent-1-en-1-yl)carbamoyl]hexa-1,3,5-trien-1-yl]-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]-2,4-dimethyloct-2-enamide
SMILES: CCCC[C@@H](C)\C=C(/C)C(=O)NC1=C[C@@](O)(\C=C\C=C\C=C\C(=O)NC2=C(O)CCC2=O)[C@@H]2O[C@@H]2C1=O
SMILES: CCCC[C@@H](C)\C=C(/C)C(=O)NC1=C[C@@](O)(\C=C\C=C\C=C\C(=O)NC2=C(O)CCC2=O)[C@@H]2O[C@@H]2C1=O
InChI key: ZGICGDCGECBVTD-LOWJZYKPSA-N
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