Vitas-M small molecule compound
4-(2-amino-3-cyano-5-oxo-4H,5H-pyrano[3,2-c]chromen-4-yl)-2-methoxyphenyl benzoate
Catalog ID
STK788533
SMILES N#CC1=C(N)Oc2c(C1c1ccc(c(c1)OC)OC(=O)c1ccccc1)c(=O)oc1c2cccc1
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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 C27H18N2O6 MW 466.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18N2O6/c1-32-21-13-16(11-12-20(21)34-26(30)15-7-3-2-4-8-15)22-18(14-28)25(29)35-24-17-9-5-6-10-19(17)33-27(31)23(22)24/h2-13,22H,29H2,1H3InChIKey
LLQGGEZGMPHVOG-UHFFFAOYSA-NSynonyms
(4(2AMINO3CYANO5OXO4HPYRANO(32C)CHROMEN4YL)2METHOXYPHENYL)BENZOATE
4(2amino3cyano5oxo45dihydropyrano(32c)chromen4yl)2methoxyphenylbenzoate
4(2amino3cyano5oxo4H5Hpyrano(32c)chromen4yl)2methoxyphenylbenzoate
COC1=C(C=CC(=C1)C2C(=C(OC3=C2C(=O)OC4=CC=CC=C43)N)C#N)OC(=O)C5=CC=CC=C5
InChI=1SC27H18N2O6c132211316(111220(21)3426(30)157324815)2218(1428)25(29)3524179561019(17)3327(31)23(22)24h21322H29H21H3
MFCD02324542
ZINC000000625533
ZINC000000625534
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