Vitas-M small molecule compound
1,8-dimethyl-17-oxapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione (non-preferred name)
Catalog ID
STK672251
SMILES O=C1OC(=O)C2C1C1(C)c3c(C2(C)c2c1cccc2)cccc3
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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 C20H16O3 MW 304.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16O3/c1-19-11-7-3-5-9-13(11)20(2,14-10-6-4-8-12(14)19)16-15(19)17(21)23-18(16)22/h3-10,15-16H,1-2H3InChIKey
XBXLNFDKAGAPGL-UHFFFAOYSA-NSynonyms
18dimethyl17oxapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
CC12C3C(C(=O)OC3=O)C(C4=CC=CC=C41)(C5=CC=CC=C25)C
InChI=1SC20H16O3c11911735913(11)20(2141064812(14)19)1615(19)17(21)2318(16)22h3101516H12H3
MFCD00398261
ZINC000068572338
ZINC000068572341
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