Vitas-M small molecule compound
9-{4-methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl}-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Catalog ID
STK723180
SMILES COc1ccc(cc1Cn1ncc(c1)[N+](=O)[O-])C1C2=C(OC3=C1C(=O)CC(C3)(C)C)CC(CC2=O)(C)C
Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.
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 C28H31N3O6 MW 505.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3O6/c1-27(2)9-19(32)25-22(11-27)37-23-12-28(3,4)10-20(33)26(23)24(25)16-6-7-21(36-5)17(8-16)14-30-15-18(13-29-30)31(34)35/h6-8,13,15,24H,9-12,14H2,1-5H3InChIKey
LJJBSHVWZDNPTP-UHFFFAOYSA-NSynonyms
404920-37-2404920372
9(4methoxy3((4nitro1Hpyrazol1yl)methyl)phenyl)3366tetramethyl345679hexahydro1Hxanthene18(2H)dione
9(4methoxy3((4nitropyrazol1yl)methyl)phenyl)3366tetramethyl4579tetrahydro2Hxanthene18dione
CC1(CC2=C(C(C3=C(O2)CC(CC3=O)(C)C)C4=CC(=C(C=C4)OC)CN5C=C(C=N5)(N+)(=O)(O))C(=O)C1)C
COc1ccc(cc1Cn1ncc(c1)(N+)(=O)(O))C1C2=C(OC3=C1C(=O)CC(C3)(C)C)CC(CC2=O)(C)C
InChI=1SC28H31N3O6c127(2)919(32)2522(1127)37231228(34)1020(33)26(23)24(25)166721(365)17(816)14301518(132930)31(34)35h68131524H91214H215H3
MFCD03679827
ZINC000002239834
ZINC02239834
ZINC2239834
Check stock
See real-time availability and sample size for STK723180 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.