Vitas-M small molecule compound
3-[(3a'S,6a'R)-5'-(1,3-benzodioxol-5-ylmethyl)-5-chloro-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
STL531604
SMILES OC(=O)CCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccc3c(c1)OCO3)C(=O)Nc1c2cc(Cl)cc1
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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 C24H20ClN3O7 MW 497.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20ClN3O7/c25-12-2-3-14-13(8-12)24(23(33)26-14)20-19(15(27-24)4-6-18(29)30)21(31)28(22(20)32)9-11-1-5-16-17(7-11)35-10-34-16/h1-3,5,7-8,15,19-20,27H,4,6,9-10H2,(H,26,33)(H,29,30)/t15?,19-,20+,24?/m1/s1InChIKey
UNZNMYRTDVBSNM-DSXKJKBRSA-NSynonyms
956975-22-716404045
3((3~(a)~(R)6~(a)~(S))5(13benzodioxol5ylmethyl)5chloro246trioxospiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)1yl)propanoicacid
3((3aS6aR)5(13benzodioxol5ylmethyl)5chloro246trioxo1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)propanoicacid
3((3aS6aR)5(benzo(d)(13)dioxol5ylmethyl)5chloro246trioxo33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)propanoicacid
956975227
InChI=1SC24H20ClN3O7c2512231413(812)24(23(33)2614)2019(15(2724)4618(29)30)21(31)28(22(20)32)911151617(711)35103416h1357815192027H46910H2(H2633)(H2930)t15?1920+24?m1s1
MFCD06765971
OC(=O)CCC1NC2((C@H)3(C@@H)1C(=O)N(C3=O)Cc1ccc3c(c1)OCO3)C(=O)Nc1c2cc(Cl)cc1
ZINC000008790294
ZINC000012882629
Check stock
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Check stock on Vitas-MAvailable files
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