Vitas-M small molecule compound
3-[(3a'S,6a'R)-5'-(1,3-benzodioxol-5-ylmethyl)-5-fluoro-2,4',6'-trioxo-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
STK583496
SMILES OC(=O)CCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccc3c(c1)OCO3)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 C24H20FN3O7 MW 481.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20FN3O7/c25-12-2-3-14-13(8-12)24(23(33)26-14)20-19(15(27-24)4-6-18(29)30)21(31)28(22(20)32)9-11-1-5-16-17(7-11)35-10-34-16/h1-3,5,7-8,15,19-20,27H,4,6,9-10H2,(H,26,33)(H,29,30)/t15?,19-,20+,24?/m1/s1InChIKey
IGLWMBUEXFZYNE-DSXKJKBRSA-NSynonyms
1013983-68-01013983680
3((3aR6aS)5(13benzodioxol5ylmethyl)5fluoro246trioxospiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)1yl)propanoicacid
3((3aS6aR)5(13benzodioxol5ylmethyl)5fluoro246trioxo1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)propanoicacid
3((3aS6aR)5(benzo(d)(13)dioxol5ylmethyl)5fluoro246trioxo33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)propanoicacid
C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4C(NC5(C4C3=O)C6=C(C=CC(=C6)F)NC5=O)CCC(=O)O
InChI=1SC24H20FN3O7c2512231413(812)24(23(33)2614)2019(15(2724)4618(29)30)21(31)28(22(20)32)911151617(711)35103416h1357815192027H46910H2(H2633)(H2930)t15?1920+24?m1s1
MFCD06771556
OC(=O)CCC1NC2((C@H)3(C@@H)1C(=O)N(C3=O)Cc1ccc3c(c1)OCO3)C(=O)Nc1c2cc(F)cc1
ZINC000009447260
ZINC000016019979
Check stock
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