HIT ID: HIT212717372
Cas No: 133705-25-6
分子式: C38H48N4O13
分子量: 768.817
常用名: Nannochelin A
氢键受体数 (HBA): 11
氢键供体数 (HBD): 6
LogP: 1.982455
IUPAC: 2-hydroxy-3-{[(2S)-6-[(2E)-N-hydroxy-3-phenylprop-2-enamido]-1-methoxy-1-oxohexan-2-yl]carbamoyl}-2-({[(2S)-6-[(2E)-N-hydroxy-3-phenylprop-2-enamido]-1-methoxy-1-oxohexan-2-yl]carbamoyl}methyl)propanoic acid
IUPAC: 2-hydroxy-3-{[(2S)-6-[(2E)-N-hydroxy-3-phenylprop-2-enamido]-1-methoxy-1-oxohexan-2-yl]carbamoyl}-2-({[(2S)-6-[(2E)-N-hydroxy-3-phenylprop-2-enamido]-1-methoxy-1-oxohexan-2-yl]carbamoyl}methyl)propanoic acid
SMILES: COC(=O)[C@H](CCCCN(O)C(=O)\C=C\c1ccccc1)NC(=O)CC(O)(CC(=O)N[C@@H](CCCCN(O)C(=O)\C=C\c1ccccc1)C(=O)OC)C(O)=O
SMILES: COC(=O)[C@H](CCCCN(O)C(=O)\C=C\c1ccccc1)NC(=O)CC(O)(CC(=O)N[C@@H](CCCCN(O)C(=O)\C=C\c1ccccc1)C(=O)OC)C(O)=O
InChI key: PLSKKAXSAYSCJS-HTPZWQEUSA-N
