Vitas-M small molecule compound
(8S,8aR,11aS)-10-(4-nitrophenyl)-8-[(3-nitrophenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Catalog ID
STK546157
SMILES O=C1N(c2ccc(cc2)[N+](=O)[O-])C(=O)[C@H]2[C@@H]1[C@@H](C(=O)c1cccc(c1)[N+](=O)[O-])N1C2c2ccccc2C=C1
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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 C27H18N4O7 MW 510.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18N4O7/c32-25(16-5-3-6-19(14-16)31(37)38)24-22-21(23-20-7-2-1-4-15(20)12-13-28(23)24)26(33)29(27(22)34)17-8-10-18(11-9-17)30(35)36/h1-14,21-24H/t21-,22+,23?,24-/m0/s1InChIKey
OMVGBLPMDFDFFN-UZLDWMDBSA-NSynonyms
1014059-85-8(8S8aR11aS)10(4nitrophenyl)8((3nitrophenyl)carbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
(8S8aR11aS)8(3nitrobenzoyl)10(4nitrophenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
1014059858
C1=CC=C2C3C4C(C(N3C=CC2=C1)C(=O)C5=CC(=CC=C5)(N+)(=O)(O))C(=O)N(C4=O)C6=CC=C(C=C6)(N+)(=O)(O)
InChI=1SC27H18N4O7c3225(1653619(1416)31(37)38)242221(2320721415(20)121328(23)24)26(33)29(27(22)34)1781018(11917)30(35)36h1142124Ht2122+23?24m0s1
MFCD18242270
O=C1N(c2ccc(cc2)(N+)(=O)(O))C(=O)(C@H)2(C@@H)1(C@@H)(C(=O)c1cccc(c1)(N+)(=O)(O))N1C2c2ccccc2C=C1
ZINC000100902300
ZINC000100902302
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.