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3-[(3S,3'S,3a'R,6a'S)-5-fluoro-2,4',6'-trioxo-5'-(tetrahydrofuran-2-ylmethyl)-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]propanoic acid

Catalog ID
STK595391
SMILES OC(=O)CC[C@@H]1N[C@]2([C@@H]3[C@H]1C(=O)N(C3=O)CC1CCCO1)C(=O)Nc1c2cc(F)cc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C21H22FN3O6 MW 431.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22FN3O6/c22-10-3-4-13-12(8-10)21(20(30)23-13)17-16(14(24-21)5-6-15(26)27)18(28)25(19(17)29)9-11-2-1-7-31-11/h3-4,8,11,14,16-17,24H,1-2,5-7,9H2,(H,23,30)(H,26,27)/t11?,14-,16-,17+,21+/m0/s1
InChIKey
QKAWCNVRMNQQIU-IVQZSHPJSA-N
Synonyms
1013755-21-9
1013755219
3((1S3S3aR6aS)5fluoro246trioxo5((tetrahydrofuran2yl)methyl)33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)propanoicacid
3((1S3S3aS6aR)5fluoro246trioxo5(oxolan2ylmethyl)spiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)1yl)propanoicacid
3((3S3S3aR6aS)5fluoro246trioxo5(tetrahydrofuran2ylmethyl)1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)propanoicacid
C1CC(OC1)CN2C(=O)C3C(NC4(C3C2=O)C5=C(C=CC(=C5)F)NC4=O)CCC(=O)O
InChI=1SC21H22FN3O6c2210341312(810)21(20(30)2313)1716(14(2421)5615(26)27)18(28)25(19(17)29)9112173111h3481114161724H12579H2(H2330)(H2627)t11?141617+21+m0s1
MFCD18246018
OC(=O)CC(C@@H)1N(C@)2((C@@H)3(C@H)1C(=O)N(C3=O)CC1CCCO1)C(=O)Nc1c2cc(F)cc1
ZINC000009129804
ZINC000013591810

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Available files

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