Chem
J-GLOBAL ID:201007054382261821
Nikkaji number:J2.867.405H
KNI-10687
(4R)-N-[(1R)-1,2,2-トリメチルプロピル]-3-[(2S,3S)-2-ヒドロキシ-3-[(2-フェニル-L-Gly-3-メチル-L-Val-)アミノ]-4-フェニルブチリル]-5,5-ジメチルチアゾリジン-4-カルボアミド
Download MOL file
Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C36 H53 N5 O5 S
Molecular formula furigana:
C36-H53-N5-O5-S
Molecular weight:
667.910
InChI:
InChI=1S/C36H53N5O5S/c1-22(34(2,3)4)38-32(45)29-36(8,9)47-21-41(29)33(46)27(42)25(20-23-16-12-10-13-17-23)39-31(44)28(35(5,6)7)40-30(43)26(37)24-18-14-11-15-19-24/h10-19,22,25-29,42H,20-21,37H2,1-9H3,(H,38,45)(H,39,44)(H,40,43)/t22-,25+,26+,27+,28-,29-/m1/s1
InChI key:
RPTQNDJJLCIOJR-OBXVIOLMSA-N
SMILES:
C[C@@H](NC(=O)[C@H]1N(CSC1(C)C)C(=O)[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](N)c1ccccc1)C(C)(C)C)C(C)(C)C
Systematic name (3):
(4R)-N-[(1R)-1,2,2-トリメチルプロピル]-3-[(2S,3S)-2-ヒドロキシ-3-[(2-フェニル-L-Gly-3-メチル-L-Val-)アミノ]-4-フェニルブチリル]-5,5-ジメチルチアゾリジン-4-カルボアミド
(4R)-3-[(2S,3S)-3-[(2S)-2-[(2S)-2-アミノ-2-フェニルアセトアミド]-3,3-ジメチルブタンアミド]-2-ヒドロキシ-4-フェニルブタノイル]-N-[(2R)-3,3-ジメチルブタン-2-イル]-5,5-ジメチル-1,3-チアゾリジン-4-カルボキサミド
(4R)-3-[(2S,3S)-3-[(2S)-2-[(2S)-2-amino-2-phenylacetamido]-3,3-dimethylbutanamido]-2-hydroxy-4-phenylbutanoyl]-N-[(2R)-3,3-dimethylbutan-2-yl]-5,5-dimethyl-1,3-thiazolidine-4-carboxamide
Other name (2):
(4R)-N-[(1R)-1,2,2-Trimethylpropyl]-3-[(2S,3S)-2-hydroxy-3-[(2-phenyl-L-Gly-3-methyl-L-Val-)amino]-4-phenylbutyryl]-5,5-dimethylthiazolidine-4-carboxamide
KNI-10687
Thsaurus map:
Return to Previous Page