Chem
J-GLOBAL ID:200907080952592797
Nikkaji number:J1.328.559D
L-Leu-L-Pro-N,O-Dimethyl-L-Tyr-Boc-L-Thr*-[2-(trimethylsilyl)ethoxymethyl]OH
L-Leu-L-Pro-N,O-ジメチル-L-Tyr-Boc-L-Thr*-[2-(トリメチルシリル)エトキシメチル]OH
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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:
C37 H62 N4 O10 Si
Molecular formula furigana:
C37-H62-N4-O10-SI
Molecular weight:
751.006
InChI:
InChI=1S/C37H62N4O10Si/c1-24(2)21-28(39-36(46)51-37(4,5)6)32(42)41-18-12-13-29(41)33(43)40(7)30(22-26-14-16-27(47-8)17-15-26)34(44)50-25(3)31(38)35(45)49-23-48-19-20-52(9,10)11/h14-17,24-25,28-31H,12-13,18-23,38H2,1-11H3,(H,39,46)/t25-,28+,29+,30+,31+/m1/s1
InChI key:
GVWUBKKTMMHIBG-XPTOATBXSA-N
SMILES:
COc1ccc(C[C@H](N(C)C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)C(=O)O[C@H](C)[C@H](N)C(=O)OCOCC[Si](C)(C)C)cc1
Systematic name (3):
L-Leu-L-Pro-N,O-ジメチル-L-Tyr-Boc-L-Thr*-[2-(トリメチルシリル)エトキシメチル]OH
[2-(トリメチルシリル)エトキシ]メチル (2S,3R)-2-アミノ-3-{[(2S)-2-{1-[(2S)-1-[(2S)-2-{[(tert-ブトキシ)カルボニル]アミノ}-4-メチルペンタノイル]ピロリジン-2-イル]-N-メチルホルムアミド}-3-(4-メトキシフェニル)プロパノイル]オキシ}ブタノアート
[2-(trimethylsilyl)ethoxy]methyl (2S,3R)-2-amino-3-{[(2S)-2-{1-[(2S)-1-[(2S)-2-{[(tert-butoxy)carbonyl]amino}-4-methylpentanoyl]pyrrolidin-2-yl]-N-methylformamido}-3-(4-methoxyphenyl)propanoyl]oxy}butanoate
Other name (1):
L-Leu-L-Pro-N,O-Dimethyl-L-Tyr-Boc-L-Thr*-[2-(trimethylsilyl)ethoxymethyl]OH
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