Vitas-M small molecule compound
(3a'S,6a'R)-5'-[2-(3,4-dimethoxyphenyl)ethyl]-5-fluoro-3'-(1-hydroxyethyl)-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
STK595498
SMILES COc1cc(CCN2C(=O)[C@H]3[C@@H](C2=O)C2(NC3C(O)C)C(=O)Nc3c2cc(F)cc3)ccc1OC
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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 C25H26FN3O6 MW 483.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26FN3O6/c1-12(30)21-19-20(25(28-21)15-11-14(26)5-6-16(15)27-24(25)33)23(32)29(22(19)31)9-8-13-4-7-17(34-2)18(10-13)35-3/h4-7,10-12,19-21,28,30H,8-9H2,1-3H3,(H,27,33)/t12?,19-,20-,21?,25?/m0/s1InChIKey
FTFKQTHVMIFSQO-HWVJPLDGSA-NSynonyms
1212493-01-0(3aR6aS)5(2(34dimethoxyphenyl)ethyl)5fluoro1(1hydroxyethyl)spiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3aS6aR)5(2(34dimethoxyphenyl)ethyl)5fluoro3(1hydroxyethyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
(3aS6aR)5(34dimethoxyphenethyl)5fluoro3(1hydroxyethyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
1212493010
CC(C1C2C(C(=O)N(C2=O)CCC3=CC(=C(C=C3)OC)OC)C4(N1)C5=C(C=CC(=C5)F)NC4=O)O
COc1cc(CCN2C(=O)(C@H)3(C@@H)(C2=O)C2(NC3C(O)C)C(=O)Nc3c2cc(F)cc3)ccc1OC
InChI=1SC25H26FN3O6c112(30)211920(25(2821)151114(26)5616(15)2724(25)33)23(32)29(22(19)31)98134717(342)18(1013)353h47101219212830H89H213H3(H2733)t12?192021?25?m0s1
MFCD06785006
ZINC000016021975
ZINC000229890938
Check stock
See real-time availability and sample size for STK595498 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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