Vitas-M small molecule compound
6-(1,3-benzodioxol-5-yl)-1,3-dimethyl-4-oxo-4H-cyclohepta[c]furan-8-yl 4-tert-butylbenzoate
Catalog ID
STL284579
SMILES O=C(c1ccc(cc1)C(C)(C)C)Oc1cc(cc(=O)c2c1c(C)oc2C)c1ccc2c(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 C29H26O6 MW 470.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26O6/c1-16-26-22(30)12-20(19-8-11-23-24(13-19)33-15-32-23)14-25(27(26)17(2)34-16)35-28(31)18-6-9-21(10-7-18)29(3,4)5/h6-14H,15H2,1-5H3InChIKey
WTMOLOUANJGQIB-UHFFFAOYSA-NSynonyms
1024057-58-6(6(13BENZODIOXOL5YL)13DIMETHYL8OXOCYCLOHEPTA(C)FURAN4YL)4TERTBUTYLBENZOATE
1024057586
6(13benzodioxol5yl)13dimethyl4oxo4Hcyclohepta(c)furan8yl4tertbutylbenzoate
CC1=C2C(=CC(=CC(=O)C2=C(O1)C)C3=CC4=C(C=C3)OCO4)OC(=O)C5=CC=C(C=C5)C(C)(C)C
InChI=1SC29H26O6c1162622(30)1220(198112324(1319)33153223)1425(27(26)17(2)3416)3528(31)186921(10718)29(34)5h614H15H215H3
MFCD24850121
ZINC000021782901
ZINC21782901
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