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llms.txt · MCPガイドプライバシーポリシー · 利用規約 · サポートv1.8.0
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2-{[(Tert-butoxy)carbonyl]amino}-3,3-dimethylbutanoic acid → (1r,2s)-1-{[(2s,4r)-1-[(1S)-1-((1s,2r)-2-hydroxy-indan-1-ylcarbamoyl)-3-phenyl-propylcarbamoyl]-4-(7-methoxy-2-phenyl-quinolin-4-yloxy)-pyrrolidine-2-carbonyl]-amino}-2-vinyl-cyclopropanecarboxylic acid

HRID 1822446
ノート
印刷プレビュー

反応式

HRID 1822446 の反応式
C(OC(NC(C(C)(C)C)C(O)=O)=O)(C)(C)C.C1[C:25]2[C:20](=[CH:21][CH:22]=[CH:23][CH:24]=2)[C@H](N)[C@@H]1O.C(O[C:33](=[O:53])[NH:34][CH:35]([C:40](=[O:52])[NH:41][CH:42]1[C:50]2[C:45](=[CH:46][CH:47]=[CH:48][CH:49]=2)[CH2:44][CH:43]1[OH:51])[C:36]([CH3:39])(C)C)(C)(C)C.ClNC(=O)[O-].C([O:61][C:62]([C:64]1([NH:69][C:70]([CH:72]2[CH2:76][CH:75]([O:77][C:78]3[C:87]4[C:82](=[CH:83][C:84]([O:88][CH3:89])=[CH:85][CH:86]=4)[N:81]=[C:80]([C:90]4[CH:95]=[CH:94][CH:93]=[CH:92][CH:91]=4)[CH:79]=3)[CH2:74][N:73]2C(=O)NC(C(=O)NC2C3C(=CC=CC=3)CC2O)C(C)(C)C)=[O:71])[CH2:66][CH:65]1[CH:67]=[CH2:68])=[O:63])C>>[OH:51][C@@H:43]1[CH2:44][C:45]2[C:50](=[CH:49][CH:48]=[CH:47][CH:46]=2)[C@@H:42]1[NH:41][C:40]([C@@H:35]([NH:34][C:33]([N:73]1[CH2:74][C@H:75]([O:77][C:78]2[C:87]3[C:82](=[CH:83][C:84]([O:88][CH3:89])=[CH:85][CH:86]=3)[N:81]=[C:80]([C:90]3[CH:95]=[CH:94][CH:93]=[CH:92][CH:91]=3)[CH:79]=2)[CH2:76][C@H:72]1[C:70]([NH:69][C@:64]1([C:62]([OH:63])=[O:61])[CH2:66][C@H:65]1[CH:67]=[CH2:68])=[O:71])=[O:53])[CH2:36][CH2:39][C:20]1[CH:25]=[CH:24][CH:23]=[CH:22][CH:21]=1)=[O:52]
参加物実験手順出典と根拠反応ノート

参加物

6

反応物 5

HCID 50468592-{[(Tert-butoxy)carbonyl]amino}-3,3-dimethylbutanoic acidHCID 9866743(1S,2R)-(-)-1-Amino-2-indanolHCID 22035886ChlorocarbamateHCID 68488177[1-(2-Hydroxy-indan-1-ylcarbamoyl)-2,2-dimethyl-propyl]-carbamic acid tert.butyl esterHCID 684916281-{[1-[1-(2-Hydroxy-indan-1-ylcarbamoyl)-2,2-dimethyl-propylcarbamoyl]-4-(7-methoxy-2-phenyl-quinolin-4-yloxy)-pyrrolidine-2-carbonyl]-amino}-2-vinyl-cyclopropanecarboxylic acid ethyl ester

生成物 1

HCID 68496226(1r,2s)-1-{[(2s,4r)-1-[(1S)-1-((1s,2r)-2-hydroxy-indan-1-ylcarbamoyl)-3-phenyl-propylcarbamoyl]-4-(7-methoxy-2-phenyl-quinolin-4-yloxy)-pyrrolidine-2-carbonyl]-amino}-2-vinyl-cyclopropanecarboxylic acid

実験手順

N-(tert.butoxycarbonyl)-L-phenethylglycine was attached to the resin as described for the preparation of compound 16 followed by reaction with (1S,2R)-cis-1-amino-2-indanol as described for the preparation of 17 and removal of the Boc group as described for 18. The afforded compound was then reacted with the chlorocarbamate achieved from 12 as described for the preparation of 13 which gave the title compound. Purity by HPLC>95%. M+H+810.4.

出典と根拠

ORDレコード
ord-a622cef8ac2448d49cdab7316a3f2ea5
出典データセット
uspto-grants-2009_10
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US07608590B2

反応ノート

読み込み中…

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