Chemical Compound

(2S)-N-[(1S)-1-{[(2R)-1-[(2S)-2-{[(1S)-5-amino-1-[(carbamoylmethyl)carbamoyl]pentyl]carbamoyl}pyrrolidin-1-yl]-1-oxo-3-sulfanylpropan-2-yl]carbamoyl}-2-carbamoylethyl]-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-methyl-3-sulfanylbutanamido]-3-(4-methoxyphenyl)propanamido]-3-phenylpropanamido]pentanediamide

(2S)-N-[(1S)-1-{[(2R)-1-[(2S)-2-{[(1S)-5-amino-1-[(carbamoylmethyl)carbamoyl]pentyl]carbamoyl}pyrrolidin-1-yl]-1-oxo-3-sulfanylpropan-2-yl]carbamoyl}-2-carbamoylethyl]-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-methyl-3-sulfanylbutanamido]-3-(4-methoxyphenyl)propanamido]-3-phenylpropanamido]pentanediamide 结构式
Primary record

(2S)-N-[(1S)-1-{[(2R)-1-[(2S)-2-{[(1S)-5-amino-1-[(carbamoylmethyl)carbamoyl]pentyl]carbamoyl}pyrrolidin-1-yl]-1-oxo-3-sulfanylpropan-2-yl]carbamoyl}-2-carbamoylethyl]-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-methyl-3-sulfanylbutanamido]-3-(4-methoxyphenyl)propanamido]-3-phenylpropanamido]pentanediamide

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
101586398
SMILES
CC(C)([C@H](C(=O)N[C@@H](CC1=CC=C(C=C1)OC)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CS)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N)N)S
Canonical SMILES
COc1ccc(C[C@H](NC(=O)[C@H](N)C(C)(C)S)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCCN)C(=O)NCC(N)=O)cc1

名称与同义词

  • J348.568D
  • 1-(3-Mercapto-D-Val)-2-(O-methyl-L-Tyr)-8-L-Lys-vasopressin
  • 3-Mercapto-D-Val-O-methyl-L-Tyr-L-Phe-L-Gln-L-Asn-L-Cys-L-Pro-L-Lys-Gly-NH2
  • (2S)-N-[(1S)-1-{[(2R)-1-[(2S)-2-{[(1S)-5-amino-1-[(carbamoylmethyl)carbamoyl]pentyl]carbamoyl}pyrrolidin-1-yl]-1-oxo-3-sulfanylpropan-2-yl]carbamoyl}-2-carbamoylethyl]-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-methyl-3-sulfanylbutanamido]-3-(4-methoxyphenyl)propanamido]-3-phenylpropanamido]pentanediamide