Vitas-M small molecule compound
9-[3-bromo-5-ethoxy-4-(prop-2-yn-1-yloxy)phenyl]-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Catalog ID
STK198884
SMILES C#CCOc1c(Br)cc(cc1OCC)C1C2=C(CCCC2=O)OC2=C1C(=O)CCC2
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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 C24H23BrO5 MW 471.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23BrO5/c1-3-11-29-24-15(25)12-14(13-20(24)28-4-2)21-22-16(26)7-5-9-18(22)30-19-10-6-8-17(27)23(19)21/h1,12-13,21H,4-11H2,2H3InChIKey
VPZQLBUVVPGQHF-UHFFFAOYSA-NSynonyms
9(3bromo5ethoxy4(prop2yn1yloxy)phenyl)345679hexahydro1Hxanthene18(2H)dione
9(3bromo5ethoxy4prop2ynoxyphenyl)345679hexahydro2Hxanthene18dione
CCOC1=C(C(=CC(=C1)C2C3=C(CCCC3=O)OC4=C2C(=O)CCC4)Br)OCC#C
InChI=1SC24H23BrO5c1311292415(25)1214(1320(24)2842)212216(26)75918(22)3019106817(27)23(19)21h1121321H411H22H3
MFCD03707457
ZINC000002997401
ZINC02997401
ZINC2997401
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