HIT ID: HIT214318124
Cas No: 78255-70-6
分子式: C71H86N14O13
分子量: 1343.554
常用名: Wy 43657
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (2S)-N-[(2S)-5-carbamimidamido-1-[(2S)-2-[(carbamoylmethyl)carbamoyl]pyrrolidin-1-yl]-1-oxopentan-2-yl]-2-[(2R)-2-[(2S)-2-[(2S)-3-hydroxy-2-[(2R)-3-(naphthalen-1-yl)-2-[(2R)-2-{[(2R)-5-oxopyrrolidin-2-yl]formamido}-3-phenylpropanamido]propanamido]propanamido]-3-(4-hydroxyphenyl)propanamido]-3-(naphthalen-1-yl)propanamido]-4-methylpentanamide
IUPAC: (2S)-N-[(2S)-5-carbamimidamido-1-[(2S)-2-[(carbamoylmethyl)carbamoyl]pyrrolidin-1-yl]-1-oxopentan-2-yl]-2-[(2R)-2-[(2S)-2-[(2S)-3-hydroxy-2-[(2R)-3-(naphthalen-1-yl)-2-[(2R)-2-{[(2R)-5-oxopyrrolidin-2-yl]formamido}-3-phenylpropanamido]propanamido]propanamido]-3-(4-hydroxyphenyl)propanamido]-3-(naphthalen-1-yl)propanamido]-4-methylpentanamide
SMILES: CC(C)C[C@H](NC(=O)[C@@H](Cc1cccc2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccc2ccccc12)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O
SMILES: CC(C)C[C@H](NC(=O)[C@@H](Cc1cccc2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccc2ccccc12)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O
InChI key: RQECPQJQISTQAH-HGIBQWSKSA-N
