Chem
J-GLOBAL ID：200907041573758798   Nikkaji number：J1.770.767A

(S)-3-[[N-(tert-Butyloxycarbonyl)-L-phenylalanyl]amino]-5-(α-D-glucopyranosyl)valeric acid methyl ester

(S)-3-[[N-(tert-ブチルオキシカルボニル)-L-フェニルアラニル]アミノ]-5-(α-D-グルコピラノシル)吉草酸メチル
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： C26H40N2O10
Molecular formula furigana： C26-H40-N2-O10
Molecular weight： 540.610
InChI： InChI=1S/C26H40N2O10/c1-26(2,3)38-25(35)28-17(12-15-8-6-5-7-9-15)24(34)27-16(13-20(30)36-4)10-11-18-21(31)23(33)22(32)19(14-29)37-18/h5-9,16-19,21-23,29,31-33H,10-14H2,1-4H3,(H,27,34)(H,28,35)/t16-,17-,18+,19+,21-,22+,23+/m0/s1
InChI key： YVCDDDLUOGXTKO-UHMVFZNOSA-N
SMILES： COC(=O)C[C@H](CC[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C
Systematic name  (3)：
  • (S)-3-[[N-(tert-ブチルオキシカルボニル)-L-フェニルアラニル]アミノ]-5-(α-D-グルコピラノシル)吉草酸メチル
  • メチル (3S)-3-[(2S)-2-{[(tert-ブトキシ)カルボニル]アミノ}-3-フェニルプロパンアミド]-5-[(2R,3R,4R,5S,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]ペンタノアート
  • methyl (3S)-3-[(2S)-2-{[(tert-butoxy)carbonyl]amino}-3-phenylpropanamido]-5-[(2R,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]pentanoate
Other name (1)：
  • (S)-3-[[N-(tert-Butyloxycarbonyl)-L-phenylalanyl]amino]-5-(α-D-glucopyranosyl)valeric acid methyl ester
Thsaurus map：
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