Vitas-M small molecule compound
(3S,3'S,3a'R,6a'S)-3'-(3,4-dihydroxybenzyl)-5-fluoro-5'-(tetrahydrofuran-2-ylmethyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Catalog ID
STK578271
SMILES Fc1ccc2c(c1)[C@]1(N[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)CC1CCCO1)Cc1ccc(c(c1)O)O)C(=O)N2
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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 C25H24FN3O6 MW 481.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24FN3O6/c26-13-4-5-16-15(10-13)25(24(34)27-16)21-20(17(28-25)8-12-3-6-18(30)19(31)9-12)22(32)29(23(21)33)11-14-2-1-7-35-14/h3-6,9-10,14,17,20-21,28,30-31H,1-2,7-8,11H2,(H,27,34)/t14?,17-,20-,21+,25+/m0/s1InChIKey
IPWBPXUQKXECND-JANRMCSGSA-NSynonyms
1014022-51-5(1S3S3aR6aS)3(34dihydroxybenzyl)5fluoro5((tetrahydrofuran2yl)methyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(1S3S3aS6aR)1((34dihydroxyphenyl)methyl)5fluoro5(oxolan2ylmethyl)spiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3S3S3aR6aS)3(34dihydroxybenzyl)5fluoro5(tetrahydrofuran2ylmethyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1014022515
C1CC(OC1)CN2C(=O)C3C(NC4(C3C2=O)C5=C(C=CC(=C5)F)NC4=O)CC6=CC(=C(C=C6)O)O
Fc1ccc2c(c1)(C@)1(N(C@H)((C@H)3(C@@H)1C(=O)N(C3=O)CC1CCCO1)Cc1ccc(c(c1)O)O)C(=O)N2
InChI=1SC25H24FN3O6c2613451615(1013)25(24(34)2716)2120(17(2825)8123618(30)19(31)912)22(32)29(23(21)33)11142173514h3691014172021283031H127811H2(H2734)t14?172021+25+m0s1
MFCD18245602
ZINC000013592151
ZINC000015972818
Check stock
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Check stock on Vitas-MAvailable files
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