Vitas-M small molecule compound
3-[(3a'S,6a'R)-7-ethyl-2,4',6'-trioxo-5'-(2-phenylethyl)-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
STL530737
SMILES CCc1cccc2c1NC(=O)C12NC([C@@H]2[C@H]1C(=O)N(C2=O)CCc1ccccc1)CCC(=O)O
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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 C26H27N3O5 MW 461.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O5/c1-2-16-9-6-10-17-22(16)27-25(34)26(17)21-20(18(28-26)11-12-19(30)31)23(32)29(24(21)33)14-13-15-7-4-3-5-8-15/h3-10,18,20-21,28H,2,11-14H2,1H3,(H,27,34)(H,30,31)/t18?,20-,21+,26?/m1/s1InChIKey
DLHWMJLGALCQLF-FOXWCKEESA-NSynonyms
956817-55-316403791
3((3~(a)~(R)6~(a)~(S))7ethyl246trioxo5(2phenylethyl)spiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)1yl)propanoicacid
3((3aS6aR)7ethyl246trioxo5(2phenylethyl)1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)propanoicacid
3((3aS6aR)7ethyl246trioxo5phenethyl33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)propanoicacid
956817553
CCc1cccc2c1NC(=O)C12NC((C@@H)2(C@H)1C(=O)N(C2=O)CCc1ccccc1)CCC(=O)O
InChI=1SC26H27N3O5c121696101722(16)2725(34)26(17)2120(18(2826)111219(30)31)23(32)29(24(21)33)1413157435815h31018202128H21114H21H3(H2734)(H3031)t18?2021+26?m1s1
MFCD06765279
ZINC000008790071
ZINC000012881601
Check stock
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