Vitas-M small molecule compound
3-[(3R,3'S,3a'S,6a'R)-5'-(2,6-dimethylphenyl)-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
STL531526
SMILES OC(=O)CC[C@@H]1N[C@@]2([C@H]3[C@@H]1C(=O)N(C3=O)c1c(C)cccc1C)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 C24H23N3O5 MW 433.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N3O5/c1-12-6-5-7-13(2)20(12)27-21(30)18-16(10-11-17(28)29)26-24(19(18)22(27)31)14-8-3-4-9-15(14)25-23(24)32/h3-9,16,18-19,26H,10-11H2,1-2H3,(H,25,32)(H,28,29)/t16-,18+,19-,24-/m0/s1InChIKey
ATACHTZILHULLQ-DOGKRZLPSA-NSynonyms
956966-01-116402860
3((1~(S)3~(R)3~(a)~(R)6~(a)~(S))5(26dimethylphenyl)246trioxospiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)1yl)propanoicacid
3((1R3S3aS6aR)5(26dimethylphenyl)246trioxo33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)propanoicacid
3((3R3S3aS6aR)5(26dimethylphenyl)246trioxo1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)propanoicacid
956966011
InChI=1SC24H23N3O5c11265713(2)20(12)2721(30)1816(101117(28)29)2624(19(18)22(27)31)14834915(14)2523(24)32h3916181926H1011H212H3(H2532)(H2829)t1618+1924m0s1
OC(=O)CC(C@@H)1N(C@@)2((C@H)3(C@@H)1C(=O)N(C3=O)c1c(C)cccc1C)C(=O)Nc1c2cccc1
ZINC000008789169
ZINC8789169
Check stock
See real-time availability and sample size for STL531526 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.