Vitas-M small molecule compound
(1'R,3'R,3a'S,6a'R)-5'-(benzo[d][1,3]dioxol-5-ylmethyl)-3'-((R)-1-hydroxyethyl)-3',3a'-dihydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(5'H,6a'H)-trione
Catalog ID
STL533460
SMILES CC([C@@H]1N[C@@]2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccc3c(c1)OCO3)C(=O)Nc1c2cccc1)O
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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 C23H21N3O6 MW 435.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O6/c1-11(27)19-17-18(23(25-19)13-4-2-3-5-14(13)24-22(23)30)21(29)26(20(17)28)9-12-6-7-15-16(8-12)32-10-31-15/h2-8,11,17-19,25,27H,9-10H2,1H3,(H,24,30)/t11?,17-,18-,19-,23-/m0/s1InChIKey
MWRPTJIDKCQYQG-CZPZABEASA-NSynonyms
956966-82-8(1~(R)3~(R)3~(a)~(R)6~(a)~(S))5(13benzodioxol5ylmethyl)1(1hydroxyethyl)spiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)246trione
(1R3R3aS6aR)5(benzo(d)(13)dioxol5ylmethyl)3((R)1hydroxyethyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
16402410
956966828
CC((C@@H)1N(C@@)2((C@H)3(C@@H)1C(=O)N(C3=O)Cc1ccc3c(c1)OCO3)C(=O)Nc1c2cccc1)O
InChI=1SC23H21N3O6c111(27)191718(23(2519)13423514(13)2422(23)30)21(29)26(20(17)28)912671516(812)32103115h281117192527H910H21H3(H2430)t11?17181923m0s1
MFCD32649950
ZINC000015957337
ZINC000015957338
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