Vitas-M small molecule compound
(3a'S,6a'R)-3'-(1-hydroxyethyl)-5'-(2-methoxybenzyl)-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
STL531072
SMILES COc1ccccc1CN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(O)C)C(=O)Nc2c1cccc2
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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 C23H23N3O5 MW 421.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O5/c1-12(27)19-17-18(23(25-19)14-8-4-5-9-15(14)24-22(23)30)21(29)26(20(17)28)11-13-7-3-6-10-16(13)31-2/h3-10,12,17-19,25,27H,11H2,1-2H3,(H,24,30)/t12?,17-,18-,19?,23?/m0/s1InChIKey
KFVSZFOJGLIEBA-KLFHCSGLSA-NSynonyms
1214633-59-6(3~(a)~(R)6~(a)~(S))1(1hydroxyethyl)5((2methoxyphenyl)methyl)spiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)246trione
(3aS6aR)3(1hydroxyethyl)5(2methoxybenzyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)3(1hydroxyethyl)5(2methoxybenzyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1214633596
16403226
COc1ccccc1CN1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2C(O)C)C(=O)Nc2c1cccc2
InChI=1SC23H23N3O5c112(27)191718(23(2519)14845915(14)2422(23)30)21(29)26(20(17)28)11137361016(13)312h3101217192527H11H212H3(H2430)t12?171819?23?m0s1
MFCD06495358
ZINC000015958642
ZINC000230018753
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