HIT ID: HIT214323729
Cas No: 276889-40-8
分子式: C38H60N12O15
分子量: 924.967
常用名: OVA (329-337)
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (4S)-4-[(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]propanamido]-3-(1H-imidazol-5-yl)propanamido]propanamido]-4-carboxybutanamido]-3-methylpentanamido]-3-carbamoylpropanamido]-4-{[(1S)-1-carboxyethyl]carbamoyl}butanoic acid
IUPAC: (4S)-4-[(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]propanamido]-3-(1H-imidazol-5-yl)propanamido]propanamido]-4-carboxybutanamido]-3-methylpentanamido]-3-carbamoylpropanamido]-4-{[(1S)-1-carboxyethyl]carbamoyl}butanoic acid
SMILES: CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](C)NC(=O)[C@H](C)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](C)C(O)=O
SMILES: CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](C)NC(=O)[C@H](C)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](C)C(O)=O
InChI key: WDUIVGVJPMWQBK-DACHUPBLSA-N
