Vitas-M small molecule compound
methyl 2-[(3S,3a'R,8a'S,8b'S)-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
STL527865
SMILES COC(=O)c1ccccc1N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cccc2
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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 C24H21N3O5 MW 431.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N3O5/c1-32-22(30)13-7-2-5-10-16(13)27-20(28)18-17-11-6-12-26(17)24(19(18)21(27)29)14-8-3-4-9-15(14)25-23(24)31/h2-5,7-10,17-19H,6,11-12H2,1H3,(H,25,31)/t17-,18+,19-,24+/m0/s1InChIKey
WYHKLPVCPMYCBN-UAKAABGRSA-NSynonyms
956946-53-516398339
956946535
COC(=O)c1ccccc1N1C(=O)(C@H)2(C@@H)(C1=O)(C@@)1(N3(C@H)2CCC3)C(=O)Nc2c1cccc2
InChI=1SC24H21N3O5c13222(30)137251016(13)2720(28)18171161226(17)24(19(18)21(27)29)14834915(14)2523(24)31h257101719H61112H21H3(H2531)t1718+1924+m0s1
methyl2((3~(S)3~(a)~(R)8~(a)~(S)8~(b)~(S))123trioxospiro(1~(H)indole343~(a)6788~(a)8~(b)hexahydropyrrolo(34a)pyrrolizine)2yl)benzoate
methyl2((3S3aR8aS8bS)123trioxo11233a6788a8bdecahydro2Hspiro(indole34pyrrolo(34a)pyrrolizin)2yl)benzoate
methyl2((3S3aR8aS8bS)123trioxo33a6788ahexahydro1Hspiro(indoline34pyrrolo(34a)pyrrolizine)2(8bH)yl)benzoate
MFCD03661735
ZINC000033905410
ZINC33905410
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Check stock on Vitas-MAvailable files
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