Vitas-M small molecule compound
(8R,8aS,11aR)-10-(2-methoxy-5-nitrophenyl)-8-[(4-methoxyphenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Catalog ID
STK553189
SMILES COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1cc(ccc1OC)[N+](=O)[O-])cccc3
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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 C28H22N4O7 MW 526.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N4O7/c1-38-18-10-7-15(8-11-18)26(33)25-23-22(24-19-6-4-3-5-16(19)14-29-31(24)25)27(34)30(28(23)35)20-13-17(32(36)37)9-12-21(20)39-2/h3-14,22-25H,1-2H3/t22-,23+,24?,25-/m1/s1InChIKey
XPPOQJRWLZLJQW-DVMHTGGUSA-NSynonyms
1014082-18-8(8R8aS11aR)10(2methoxy5nitrophenyl)8((4methoxyphenyl)carbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine911(8aH10H)dione
(8R8aS11aR)10(2methoxy5nitrophenyl)8(4methoxybenzoyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine911(8aH10H)dione
1014082188
COC1=CC=C(C=C1)C(=O)C2C3C(C4N2N=CC5=CC=CC=C45)C(=O)N(C3=O)C6=C(C=CC(=C6)(N+)(=O)(O))OC
COc1ccc(cc1)C(=O)(C@@H)1N2N=Cc3c(C2(C@H)2(C@@H)1C(=O)N(C2=O)c1cc(ccc1OC)(N+)(=O)(O))cccc3
InChI=1SC28H22N4O7c1381810715(81118)26(33)252322(2419643516(19)142931(24)25)27(34)30(28(23)35)201317(32(36)37)91221(20)392h3142225H12H3t2223+24?25m1s1
MFCD18242700
ZINC000100959390
ZINC000100959395
Check stock
See real-time availability and sample size for STK553189 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.