Vitas-M small molecule compound
(3S,3a'R,8a'S,8b'S)-1-ethyl-2'-(4-nitrophenyl)-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
STL054872
SMILES CCN1c2ccccc2[C@@]2(C1=O)N1CCC[C@H]1[C@@H]1[C@H]2C(=O)N(C1=O)c1ccc(cc1)[N+](=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 C24H22N4O5 MW 446.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N4O5/c1-2-25-17-7-4-3-6-16(17)24(23(25)31)20-19(18-8-5-13-26(18)24)21(29)27(22(20)30)14-9-11-15(12-10-14)28(32)33/h3-4,6-7,9-12,18-20H,2,5,8,13H2,1H3/t18-,19+,20-,24+/m0/s1InChIKey
HHQCQRRWVWWAQL-CMCWBKRRSA-NSynonyms
1013853-55-8(3aR4S8aS8bS)1ethyl2(4nitrophenyl)spiro(3a6788a8bhexahydropyrrolo(34a)pyrrolizine43indole)123trione
(3S3aR8aS8bS)1ethyl2(4nitrophenyl)3a6788a8bhexahydro1Hspiro(indole34pyrrolo(34a)pyrrolizine)123(1H2H)trione
(3S3aR8aS8bS)1ethyl2(4nitrophenyl)6788atetrahydro1Hspiro(indoline34pyrrolo(34a)pyrrolizine)123(2H3aH8bH)trione
1013853558
CCN1C2=CC=CC=C2C3(C1=O)C4C(C5N3CCC5)C(=O)N(C4=O)C6=CC=C(C=C6)(N+)(=O)(O)
CCN1c2ccccc2(C@@)2(C1=O)N1CCC(C@H)1(C@@H)1(C@H)2C(=O)N(C1=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC24H22N4O5c122517743616(17)24(23(25)31)2019(18851326(18)24)21(29)27(22(20)30)1491115(121014)28(32)33h34679121820H25813H21H3t1819+2024+m0s1
MFCD18249635
ZINC000015997081
ZINC15997081
Check stock
See real-time availability and sample size for STL054872 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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