Vitas-M small molecule compound
(3S,3a'R,8a'S,8b'S)-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
STK550727
SMILES O=C1N(c2ccc(cc2)[N+](=O)[O-])C(=O)[C@@H]2[C@H]1[C@@H]1CCCN1[C@]12C(=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 C22H18N4O5 MW 418.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N4O5/c27-19-17-16-6-3-11-24(16)22(14-4-1-2-5-15(14)23-21(22)29)18(17)20(28)25(19)12-7-9-13(10-8-12)26(30)31/h1-2,4-5,7-10,16-18H,3,6,11H2,(H,23,29)/t16-,17+,18-,22+/m0/s1InChIKey
PTAAMSSDVVNNBX-RQXXJAGISA-NSynonyms
1013748-59-8(3S3aR8aS8bS)2(4nitrophenyl)3a6788a8bhexahydro1Hspiro(indole34pyrrolo(34a)pyrrolizine)123(1H2H)trione
(3S3aR8aS8bS)2(4nitrophenyl)6788atetrahydro1Hspiro(indoline34pyrrolo(34a)pyrrolizine)123(2H3aH8bH)trione
(3S3aR8aS8bS)2(4nitrophenyl)spiro(1Hindole343a6788a8bhexahydropyrrolo(34a)pyrrolizine)123trione
1013748598
C1CC2C3C(C(=O)N(C3=O)C4=CC=C(C=C4)(N+)(=O)(O))C5(N2C1)C6=CC=CC=C6NC5=O
InChI=1SC22H18N4O5c27191716631124(16)22(14412515(14)2321(22)29)18(17)20(28)25(19)127913(10812)26(30)31h12457101618H3611H2(H2329)t1617+1822+m0s1
MFCD18242539
O=C1N(c2ccc(cc2)(N+)(=O)(O))C(=O)(C@@H)2(C@H)1(C@@H)1CCCN1(C@)12C(=O)Nc2c1cccc2
ZINC000013685985
ZINC13685985
Check stock
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Check stock on Vitas-MAvailable files
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