Vitas-M small molecule compound

2-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)phenyl acetate

Catalog ID
STL325490
SMILES CC(=O)Oc1ccccc1C1C2=C(OC3=C1C(=O)CC(C3)(C)C)CC(CC2=O)(C)C

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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 C25H28O5 MW 408.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28O5/c1-14(26)29-18-9-7-6-8-15(18)21-22-16(27)10-24(2,3)12-19(22)30-20-13-25(4,5)11-17(28)23(20)21/h6-9,21H,10-13H2,1-5H3
InChIKey
BXGHQZSUCAQRBW-UHFFFAOYSA-N
Synonyms
15781-65-4
(2(3366tetramethyl18dioxo4579tetrahydro2Hxanthen9yl)phenyl)acetate
15781654
2(3366tetramethyl18dioxo23456789octahydro1Hxanthen9yl)phenylacetate
CC(=O)OC1=CC=CC=C1C2C3=C(CC(CC3=O)(C)C)OC4=C2C(=O)CC(C4)(C)C
InChI=1SC25H28O5c114(26)2918976815(18)212216(27)1024(23)1219(22)30201325(45)1117(28)23(20)21h6921H1013H215H3
MFCD01875390
ZINC000002270992
ZINC02270992
ZINC2270992

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Available files

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