Vitas-M small molecule compound
4-[3'-(4-hydroxybenzyl)-2,4',6'-trioxo-1,2,2',3',3a',4',6',6a'-octahydro-5'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-5'-yl]phenyl acetate
Catalog ID
STL529046
SMILES CC(=O)Oc1ccc(cc1)N1C(=O)C2C(C1=O)C1(NC2Cc2ccc(cc2)O)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 C28H23N3O6 MW 497.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23N3O6/c1-15(32)37-19-12-8-17(9-13-19)31-25(34)23-22(14-16-6-10-18(33)11-7-16)30-28(24(23)26(31)35)20-4-2-3-5-21(20)29-27(28)36/h2-13,22-24,30,33H,14H2,1H3,(H,29,36)InChIKey
BBFYSJWNBAOMBW-UHFFFAOYSA-NSynonyms
(4(1((4hydroxyphenyl)methyl)246trioxospiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)5yl)phenyl)acetate
(4(1((4HYDROXYPHENYL)METHYL)246TRIOXOSPIRO(123A6ATETRAHYDROPYRROLO(34C)PYRROLE331HINDOLE)5YL)PHENYL)ACETATE
4((1R3S3aS6aR)3(4hydroxybenzyl)246trioxo3a466atetrahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)5(3H)yl)phenylacetate
4(3(4hydroxybenzyl)246trioxo12233a466aoctahydro5Hspiro(indole31pyrrolo(34c)pyrrol)5yl)phenylacetate
4836246
CC(=O)Oc1ccc(cc1)N1C(=O)(C@H)2(C@@H)(C1=O)(C@)1(N(C@H)2Cc2ccc(cc2)O)C(=O)Nc2c1cccc2
InChI=1SC28H23N3O6c115(32)371912817(91319)3125(34)2322(141661018(33)11716)3028(24(23)26(31)35)20423521(20)2927(28)36h21322243033H14H21H3(H2936)
MFCD31753917
ZINC000015958476
ZINC000504255313
Check stock
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Check stock on Vitas-MAvailable files
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