Vitas-M small molecule compound
3,3'-({4-methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl}methanediyl)bis(4-hydroxy-2H-chromen-2-one)
Catalog ID
STK527817
SMILES COc1ccc(cc1Cn1ncc(c1)[N+](=O)[O-])C(c1c(=O)oc2c(c1O)cccc2)c1c(=O)oc2c(c1O)cccc2
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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 C30H21N3O9 MW 567.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H21N3O9/c1-40-21-11-10-16(12-17(21)14-32-15-18(13-31-32)33(38)39)24(25-27(34)19-6-2-4-8-22(19)41-29(25)36)26-28(35)20-7-3-5-9-23(20)42-30(26)37/h2-13,15,24,34-35H,14H2,1H3InChIKey
UWCPSEMXBPIRSW-UHFFFAOYSA-NSynonyms
2HYDROXY3((2HYDROXY4OXOCHROMEN3YL)(4METHOXY3((4NITROPYRAZOL1YL)METHYL)PHENYL)METHYL)CHROMEN4ONE
33((4methoxy3((4nitro1Hpyrazol1yl)methyl)phenyl)methanediyl)bis(4hydroxy2Hchromen2one)
33((4methoxy3((4nitro1Hpyrazol1yl)methyl)phenyl)methylene)bis(4hydroxy2Hchromen2one)
4hydroxy3((4hydroxy2oxochromen3yl)(4methoxy3((4nitropyrazol1yl)methyl)phenyl)methyl)chromen2one
COC1=C(C=C(C=C1)C(C2=C(C3=CC=CC=C3OC2=O)O)C4=C(C5=CC=CC=C5OC4=O)O)CN6C=C(C=N6)(N+)(=O)(O)
COc1ccc(cc1Cn1ncc(c1)(N+)(=O)(O))C(c1c(=O)oc2c(c1O)cccc2)c1c(=O)oc2c(c1O)cccc2
InChI=1SC30H21N3O9c14021111016(1217(21)14321518(133132)33(38)39)24(2527(34)19624822(19)4129(25)36)2628(35)20735923(20)4230(26)37h21315243435H14H21H3
MFCD02164399
ZINC000102403944
ZINC102403944
Check stock
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Check stock on Vitas-MAvailable files
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