Vitas-M small molecule compound
(3a'S,6a'R)-5'-[2-(3,4-dimethoxyphenyl)ethyl]-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
STK607718
SMILES COc1cc(CCN2C(=O)[C@H]3[C@@H](C2=O)C2(NC3C(O)C)C(=O)Nc3c2cccc3)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 C25H27N3O6 MW 465.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O6/c1-13(29)21-19-20(25(27-21)15-6-4-5-7-16(15)26-24(25)32)23(31)28(22(19)30)11-10-14-8-9-17(33-2)18(12-14)34-3/h4-9,12-13,19-21,27,29H,10-11H2,1-3H3,(H,26,32)/t13?,19-,20-,21?,25?/m0/s1InChIKey
KLZCNRCJNIYBSI-ACRFIPSQSA-NSynonyms
1212494-39-7(3aR6aS)5(2(34dimethoxyphenyl)ethyl)1(1hydroxyethyl)spiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3aS6aR)5(2(34dimethoxyphenyl)ethyl)3(1hydroxyethyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
(3aS6aR)5(34dimethoxyphenethyl)3(1hydroxyethyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
1212494397
CC(C1C2C(C(=O)N(C2=O)CCC3=CC(=C(C=C3)OC)OC)C4(N1)C5=CC=CC=C5NC4=O)O
COc1cc(CCN2C(=O)(C@H)3(C@@H)(C2=O)C2(NC3C(O)C)C(=O)Nc3c2cccc3)ccc1OC
InChI=1SC25H27N3O6c113(29)211920(25(2721)15645716(15)2624(25)32)23(31)28(22(19)30)1110148917(332)18(1214)343h49121319212729H1011H213H3(H2632)t13?192021?25?m0s1
MFCD06794602
ZINC000016025236
ZINC000229900248
Check stock
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Check stock on Vitas-MAvailable files
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