Vitas-M small molecule compound
3-[(3R,3'S,3a'S,6a'R)-5'-(4-methoxybenzyl)-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]propanoic acid
Catalog ID
STL530217
SMILES COc1ccc(cc1)CN1C(=O)[C@H]2[C@@H](C1=O)[C@]1(N[C@H]2CCC(=O)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 C24H23N3O6 MW 449.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N3O6/c1-33-14-8-6-13(7-9-14)12-27-21(30)19-17(10-11-18(28)29)26-24(20(19)22(27)31)15-4-2-3-5-16(15)25-23(24)32/h2-9,17,19-20,26H,10-12H2,1H3,(H,25,32)(H,28,29)/t17-,19+,20-,24-/m0/s1InChIKey
KWKFEPAZYTYSCC-GHCZAOPSSA-NSynonyms
956925-54-516402096
3((1~(S)3~(R)3~(a)~(R)6~(a)~(S))5((4methoxyphenyl)methyl)246trioxospiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)1yl)propanoicacid
3((1R3S3aS6aR)5(4methoxybenzyl)246trioxo33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)propanoicacid
3((3R3S3aS6aR)5(4methoxybenzyl)246trioxo1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)propanoicacid
956925545
COc1ccc(cc1)CN1C(=O)(C@H)2(C@@H)(C1=O)(C@)1(N(C@H)2CCC(=O)O)C(=O)Nc2c1cccc2
InChI=1SC24H23N3O6c133148613(7914)122721(30)1917(101118(28)29)2624(20(19)22(27)31)15423516(15)2523(24)32h2917192026H1012H21H3(H2532)(H2829)t1719+2024m0s1
ZINC000012874007
ZINC12874007
Check stock
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Check stock on Vitas-MAvailable files
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