Vitas-M small molecule compound
3-(1,3-benzodioxol-5-ylmethylidene)-1,5-dioxaspiro[5.5]undecane-2,4-dione
Catalog ID
STK392808
SMILES O=C1OC2(CCCCC2)OC(=O)C1=Cc1ccc2c(c1)OCO2
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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 C17H16O6 MW 316.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16O6/c18-15-12(8-11-4-5-13-14(9-11)21-10-20-13)16(19)23-17(22-15)6-2-1-3-7-17/h4-5,8-9H,1-3,6-7,10H2InChIKey
VBYUBYZFXHSCIQ-UHFFFAOYSA-NSynonyms
3(13BENZODIOXOL5YLMETHYLIDENE)15DIOXASPIRO(55)UNDECANE24DIONE
3(2HBENZO(34D)13DIOXOLAN5YLMETHYLENE)15DIOXASPIRO(55)UNDECANE24DIONE
9(13BENZODIOXOL5YLMETHYLIDENE)711DIOXASPIRO(55)UNDECANE810DIONE
C1CCC2(CC1)OC(=O)C(=CC3=CC4=C(C=C3)OCO4)C(=O)O2
InChI=1SC17H16O6c181512(811451314(911)21102013)16(19)2317(2215)6213717h4589H136710H2
MFCD01970575
ZINC000000187043
ZINC00187043
ZINC187043
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