Vitas-M small molecule compound
methyl {2-[(2Z)-2-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-3,7-dioxo-2,3,8,9-tetrahydro-7H-furo[2,3-f]chromen-9-yl]phenoxy}acetate
Catalog ID
STL546050
SMILES COC(=O)COc1ccccc1C1CC(=O)Oc2c1c1O/C(=C\c3ccc4c(c3)OCCO4)/C(=O)c1cc2
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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 C29H22O9 MW 514.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22O9/c1-33-26(31)15-36-20-5-3-2-4-17(20)19-14-25(30)37-22-9-7-18-28(32)24(38-29(18)27(19)22)13-16-6-8-21-23(12-16)35-11-10-34-21/h2-9,12-13,19H,10-11,14-15H2,1H3/b24-13-InChIKey
KHZBBHOMHHAJJT-CFRMEGHHSA-NSynonyms
(Z)methyl2(2(2((23dihydrobenzo(b)(14)dioxin6yl)methylene)37dioxo3789tetrahydro2Hfuro(23f)chromen9yl)phenoxy)acetate
110208113
COC(=O)COc1ccccc1C1CC(=O)Oc2c1c1OC(=Cc3ccc4c(c3)OCCO4)C(=O)c1cc2
InChI=1SC29H22O9c13326(31)153620532417(20)191425(30)3722971828(32)24(3829(18)27(19)22)1316682123(1216)3511103421h29121319H10111415H21H3b2413
methyl(2((2Z)2(23dihydro14benzodioxin6ylmethylidene)37dioxo2389tetrahydro7Hfuro(23f)chromen9yl)phenoxy)acetate
methyl2(2((2~(Z))2(23dihydro14benzodioxin6ylmethylidene)37dioxo89dihydrofuro(23f)chromen9yl)phenoxy)acetate
MFCD29056467
ZINC000253407956
ZINC001082732977
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