Vitas-M small molecule compound
3-(4-hydroxy-3-methoxybenzylidene)-1,5-dioxaspiro[5.5]undecane-2,4-dione
Catalog ID
STK796644
SMILES COc1cc(ccc1O)C=C1C(=O)OC2(OC1=O)CCCCC2
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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 C17H18O6 MW 318.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18O6/c1-21-14-10-11(5-6-13(14)18)9-12-15(19)22-17(23-16(12)20)7-3-2-4-8-17/h5-6,9-10,18H,2-4,7-8H2,1H3InChIKey
ABRUVDFLLGTYEP-UHFFFAOYSA-NSynonyms
3((4hydroxy3methoxyphenyl)methylidene)15dioxaspiro(55)undecane24dione
3(4hydroxy3methoxybenzylidene)15dioxaspiro(55)undecane24dione
9((4HYDROXY3METHOXYPHENYL)METHYLIDENE)711DIOXASPIRO(55)UNDECANE810DIONE
COC1=C(C=CC(=C1)C=C2C(=O)OC3(CCCCC3)OC2=O)O
InChI=1SC17H18O6c121141011(5613(14)18)91215(19)2217(2316(12)20)7324817h5691018H2478H21H3
MFCD03036581
ZINC000000091894
ZINC00091894
ZINC91894
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