Vitas-M small molecule compound
(3a'S,6a'R)-3'-(1H-indol-3-ylmethyl)-5'-(3-methoxypropyl)-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
STL534985
SMILES COCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)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 C26H26N4O4 MW 458.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O4/c1-34-12-6-11-30-23(31)21-20(13-15-14-27-18-9-4-2-7-16(15)18)29-26(22(21)24(30)32)17-8-3-5-10-19(17)28-25(26)33/h2-5,7-10,14,20-22,27,29H,6,11-13H2,1H3,(H,28,33)/t20?,21-,22+,26?/m1/s1InChIKey
KCYWLJXGKNZHBW-YPHDTHBOSA-NSynonyms
1014061-86-9(3~(a)~(R)6~(a)~(S))1(1~(H)indol3ylmethyl)5(3methoxypropyl)spiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)246trione
(3aS6aR)3((1Hindol3yl)methyl)5(3methoxypropyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)3(1Hindol3ylmethyl)5(3methoxypropyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1014061869
17571959
COCCCN1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2Cc2c(nH)c3c2cccc3)C(=O)Nc2c1cccc2
InChI=1SC26H26N4O4c134126113023(31)2120(1315142718942716(15)18)2926(22(21)24(30)32)178351019(17)2825(26)33h257101420222729H61113H21H3(H2833)t20?2122+26?m1s1
MFCD06769825
ZINC000012900578
ZINC000020760252
Check stock
See real-time availability and sample size for STL534985 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.