HIT ID: HIT212716731
Cas No: 287402-88-4
分子式: C15H25N5O7S
分子量: 419.45
常用名: LA-810
氢键受体数 (HBA): 10
氢键供体数 (HBD): 5
LogP: -7.1544075
IUPAC: (2S)-2-amino-4-({[(carboxymethyl)carbamoyl][1-methyl-4-(nitrososulfanyl)piperidin-4-yl]methyl}carbamoyl)butanoic acid
IUPAC: (2S)-2-amino-4-({[(carboxymethyl)carbamoyl][1-methyl-4-(nitrososulfanyl)piperidin-4-yl]methyl}carbamoyl)butanoic acid
SMILES: CN1CCC(CC1)(SN=O)C(NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O
SMILES: CN1CCC(CC1)(SN=O)C(NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O
InChI key: KRTHUBMGFKGGAJ-QHGLUPRGSA-N
