Vitas-M small molecule compound
(3S,3a'R,8a'S,8b'S)-2'-(4-acetylphenyl)-5,7-dimethyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Catalog ID
STL537363
SMILES Cc1cc(C)c2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)C(=O)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 C26H25N3O4 MW 443.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O4/c1-13-11-14(2)22-18(12-13)26(25(33)27-22)21-20(19-5-4-10-28(19)26)23(31)29(24(21)32)17-8-6-16(7-9-17)15(3)30/h6-9,11-12,19-21H,4-5,10H2,1-3H3,(H,27,33)/t19-,20+,21-,26+/m0/s1InChIKey
MTLSHDKGKQPPCH-KKPNIWNPSA-NSynonyms
957046-39-8(3~(S)3~(a)~(R)8~(a)~(S)8~(b)~(S))2(4acetylphenyl)57dimethylspiro(1~(H)indole343~(a)6788~(a)8~(b)hexahydropyrrolo(34a)pyrrolizine)123trione
(3S3aR8aS8bS)2(4acetylphenyl)57dimethyl3a6788a8bhexahydro1Hspiro(indole34pyrrolo(34a)pyrrolizine)123(1H2H)trione
(3S3aR8aS8bS)2(4acetylphenyl)57dimethyl6788atetrahydro1Hspiro(indoline34pyrrolo(34a)pyrrolizine)123(2H3aH8bH)trione
16400825
957046398
Cc1cc(C)c2c(c1)(C@@)1(C(=O)N2)N2CCC(C@H)2(C@@H)2(C@H)1C(=O)N(C2=O)c1ccc(cc1)C(=O)C
InChI=1SC26H25N3O4c1131114(2)2218(1213)26(25(33)2722)2120(19541028(19)26)23(31)29(24(21)32)178616(7917)15(3)30h6911121921H4510H213H3(H2733)t1920+2126+m0s1
MFCD05672090
ZINC000059475825
ZINC59475825
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.