Vitas-M small molecule compound
(3a'S,6a'R)-3'-(1H-indol-3-ylmethyl)-5'-(3-methoxypropyl)-5-methyl-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
STL534833
SMILES COCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cc(C)cc2
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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 C27H28N4O4 MW 472.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O4/c1-15-8-9-20-18(12-15)27(26(34)29-20)23-22(24(32)31(25(23)33)10-5-11-35-2)21(30-27)13-16-14-28-19-7-4-3-6-17(16)19/h3-4,6-9,12,14,21-23,28,30H,5,10-11,13H2,1-2H3,(H,29,34)/t21?,22-,23+,27?/m1/s1InChIKey
LIBHLBXZGHODBP-FPAXGFGJSA-NSynonyms
956827-68-2(3~(a)~(R)6~(a)~(S))1(1~(H)indol3ylmethyl)5(3methoxypropyl)5methylspiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)246trione
(3aS6aR)3((1Hindol3yl)methyl)5(3methoxypropyl)5methyl33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)3(1Hindol3ylmethyl)5(3methoxypropyl)5methyl3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
16405191
956827682
COCCCN1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2Cc2c(nH)c3c2cccc3)C(=O)Nc2c1cc(C)cc2
InChI=1SC27H28N4O4c115892018(1215)27(26(34)2920)2322(24(32)31(25(23)33)10511352)21(3027)1316142819743617(16)19h3469121421232830H5101113H212H3(H2934)t21?2223+27?m1s1
MFCD06769334
ZINC000020756655
ZINC000020756673
Check stock
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Check stock on Vitas-MAvailable files
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