Vitas-M small molecule compound
(3a'S,6a'R)-3'-(4-hydroxybenzyl)-5'-(2-phenylethyl)-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
STL530863
SMILES Oc1ccc(cc1)CC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)CCc1ccccc1)C(=O)Nc1c2cccc1
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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 C28H25N3O4 MW 467.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O4/c32-19-12-10-18(11-13-19)16-22-23-24(28(30-22)20-8-4-5-9-21(20)29-27(28)35)26(34)31(25(23)33)15-14-17-6-2-1-3-7-17/h1-13,22-24,30,32H,14-16H2,(H,29,35)/t22?,23-,24+,28?/m1/s1InChIKey
WIQJMTBNUZQGRM-WUIRLBBUSA-NSynonyms
956817-40-6(3~(a)~(R)6~(a)~(S))1((4hydroxyphenyl)methyl)5(2phenylethyl)spiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)246trione
(3aS6aR)3(4hydroxybenzyl)5(2phenylethyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
(3aS6aR)3(4hydroxybenzyl)5phenethyl33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
16403723
956817406
InChI=1SC28H25N3O4c3219121018(111319)16222324(28(3022)20845921(20)2927(28)35)26(34)31(25(23)33)1514176213717h11322243032H1416H2(H2935)t22?2324+28?m1s1
MFCD06765084
Oc1ccc(cc1)CC1NC2((C@H)3(C@@H)1C(=O)N(C3=O)CCc1ccccc1)C(=O)Nc1c2cccc1
ZINC000015959380
ZINC000015959383
Check stock
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Check stock on Vitas-MAvailable files
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