Vitas-M small molecule compound
2-{(3a'S,6a'R)-5'-[2-(3,4-dimethoxyphenyl)ethyl]-7-ethyl-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}acetamide
Catalog ID
STL531251
SMILES COc1cc(CCN2C(=O)[C@H]3[C@@H](C2=O)C2(NC3CC(=O)N)C(=O)Nc3c2cccc3CC)ccc1OC
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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 C27H30N4O6 MW 506.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N4O6/c1-4-15-6-5-7-16-23(15)29-26(35)27(16)22-21(17(30-27)13-20(28)32)24(33)31(25(22)34)11-10-14-8-9-18(36-2)19(12-14)37-3/h5-9,12,17,21-22,30H,4,10-11,13H2,1-3H3,(H2,28,32)(H,29,35)/t17?,21-,22+,27?/m1/s1InChIKey
IPOBZGPDCBNMIG-VKKUGUIDSA-NSynonyms
956956-83-516404409
2((3~(a)~(R)6~(a)~(S))5(2(34dimethoxyphenyl)ethyl)7ethyl246trioxospiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)1yl)acetamide
2((3aS6aR)5(2(34dimethoxyphenyl)ethyl)7ethyl246trioxo1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)acetamide
2((3aS6aR)5(34dimethoxyphenethyl)7ethyl246trioxo33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)acetamide
956956835
COc1cc(CCN2C(=O)(C@H)3(C@@H)(C2=O)C2(NC3CC(=O)N)C(=O)Nc3c2cccc3CC)ccc1OC
InChI=1SC27H30N4O6c14156571623(15)2926(35)27(16)2221(17(3027)1320(28)32)24(33)31(25(22)34)1110148918(362)19(1214)373h591217212230H4101113H213H3(H22832)(H2935)t17?2122+27?m1s1
MFCD06767003
ZINC000015968052
ZINC000015968058
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.