Vitas-M small molecule compound
(2Z,6E)-2,6-bis(2,4,5-trimethoxybenzylidene)cyclohexanone
Catalog ID
STK955988
SMILES COc1cc(OC)c(cc1/C=C/1\CCC/C(=C/c2cc(OC)c(cc2OC)OC)/C1=O)OC
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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 C26H30O7 MW 454.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30O7/c1-28-20-14-24(32-5)22(30-3)12-18(20)10-16-8-7-9-17(26(16)27)11-19-13-23(31-4)25(33-6)15-21(19)29-2/h10-15H,7-9H2,1-6H3/b16-10-,17-11+InChIKey
QOQLPPVRTBCSGN-VRNBXGKJSA-NSynonyms
14894-78-1(2E6Z)26BIS((245TRIMETHOXYPHENYL)METHYLIDENE)CYCLOHEXAN1ONE
(2Z6E)26bis(245trimethoxybenzylidene)cyclohexanone
14894781
26BIS(245TRIMETHOXYBENZYLIDENE)CYCLOHEXANONE
COC1=CC(=C(C=C1C=C2CCCC(=CC3=CC(=C(C=C3OC)OC)OC)C2=O)OC)OC
COc1cc(OC)c(cc1C=C1CCCC(=Cc2cc(OC)c(cc2OC)OC)C1=O)OC
InChI=1SC26H30O7c128201424(325)22(303)1218(20)101687917(26(16)27)11191323(314)25(336)1521(19)292h1015H79H216H3b16101711+
MFCD03074100
ZINC000008454820
ZINC08454820
ZINC8454820
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