Vitas-M small molecule compound
ethyl 4-[(3S,3a'R,8a'S,8b'S)-7-ethyl-1',2,3'-trioxo-1,1',2,3',3a',6',7',8',8a',8b'-decahydro-2'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizin]-2'-yl]benzoate
Catalog ID
STL533453
SMILES CCOC(=O)c1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cccc2CC
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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 C27H27N3O5 MW 473.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O5/c1-3-15-7-5-8-18-22(15)28-26(34)27(18)21-20(19-9-6-14-29(19)27)23(31)30(24(21)32)17-12-10-16(11-13-17)25(33)35-4-2/h5,7-8,10-13,19-21H,3-4,6,9,14H2,1-2H3,(H,28,34)/t19-,20+,21-,27+/m0/s1InChIKey
DWZCDFFQIFCPHF-ZZWZOVRCSA-NSynonyms
956815-76-2956815762
CCOC(=O)c1ccc(cc1)N1C(=O)(C@H)2(C@@H)(C1=O)(C@@)1(N3(C@H)2CCC3)C(=O)Nc2c1cccc2CC
ethyl4((3S3aR8aS8bS)7ethyl123trioxo11233a6788a8bdecahydro2Hspiro(indole34pyrrolo(34a)pyrrolizin)2yl)benzoate
ethyl4((3S3aR8aS8bS)7ethyl123trioxo33a6788ahexahydro1Hspiro(indoline34pyrrolo(34a)pyrrolizine)2(8bH)yl)benzoate
MFCD06493599
ZINC000059485600
ZINC59485600
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