Vitas-M small molecule compound
(3R,3'R,3a'S,6a'R)-5'-benzyl-3'-(hydroxymethyl)-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
STL531952
SMILES OC[C@@H]1N[C@@]2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccccc1)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 C21H19N3O4 MW 377.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O4/c25-11-15-16-17(19(27)24(18(16)26)10-12-6-2-1-3-7-12)21(23-15)13-8-4-5-9-14(13)22-20(21)28/h1-9,15-17,23,25H,10-11H2,(H,22,28)/t15-,16+,17-,21-/m0/s1InChIKey
HQQYQASDYPZIRL-DLRJPAPCSA-NSynonyms
956761-22-1(1~(R)3~(R)3~(a)~(R)6~(a)~(S))5benzyl1(hydroxymethyl)spiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)246trione
(1R3R3aS6aR)5benzyl3(hydroxymethyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3R3R3aS6aR)5benzyl3(hydroxymethyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
11876440
956761221
InChI=1SC21H19N3O4c2511151617(19(27)24(18(16)26)10126213712)21(2315)13845914(13)2220(21)28h1915172325H1011H2(H2228)t1516+1721m0s1
OC(C@@H)1N(C@@)2((C@H)3(C@@H)1C(=O)N(C3=O)Cc1ccccc1)C(=O)Nc1c2cccc1
ZINC000015958561
ZINC15958561
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