Vitas-M small molecule compound

3-[(3a'S,6a'R)-5'-(1,3-benzodioxol-5-ylmethyl)-6,7-dimethyl-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]propanamide

Catalog ID
STL530374
SMILES NC(=O)CCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccc3c(c1)OCO3)C(=O)Nc1c2ccc(c1C)C

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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 C26H26N4O6 MW 490.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O6/c1-12-3-5-15-22(13(12)2)28-25(34)26(15)21-20(16(29-26)6-8-19(27)31)23(32)30(24(21)33)10-14-4-7-17-18(9-14)36-11-35-17/h3-5,7,9,16,20-21,29H,6,8,10-11H2,1-2H3,(H2,27,31)(H,28,34)/t16?,20-,21+,26?/m1/s1
InChIKey
QRDNMMLBFGSOCA-USNAGLCPSA-N
Synonyms
956983-86-1
16404894
3((3~(a)~(R)6~(a)~(S))5(13benzodioxol5ylmethyl)67dimethyl246trioxospiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)1yl)propanamide
3((3aS6aR)5(13benzodioxol5ylmethyl)67dimethyl246trioxo1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)propanamide
3((3aS6aR)5(benzo(d)(13)dioxol5ylmethyl)67dimethyl246trioxo33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)propanamide
956983861
InChI=1SC26H26N4O6c112351522(13(12)2)2825(34)26(15)2120(16(2926)6819(27)31)23(32)30(24(21)33)1014471718(914)36113517h357916202129H681011H212H3(H22731)(H2834)t16?2021+26?m1s1
MFCD06768386
NC(=O)CCC1NC2((C@H)3(C@@H)1C(=O)N(C3=O)Cc1ccc3c(c1)OCO3)C(=O)Nc1c2ccc(c1C)C
ZINC000015969353
ZINC000015969359

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Available files

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