Vitas-M small molecule compound
3-hydroxy-5,5-dimethyl-2-(9H-xanthen-9-yl)cyclohex-2-en-1-one
Catalog ID
STK868191
SMILES OC1=C(C(=O)CC(C1)(C)C)C1c2ccccc2Oc2c1cccc2
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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 C21H20O3 MW 320.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20O3/c1-21(2)11-15(22)20(16(23)12-21)19-13-7-3-5-9-17(13)24-18-10-6-4-8-14(18)19/h3-10,19,22H,11-12H2,1-2H3InChIKey
ZTNXNBBBSRYOQT-UHFFFAOYSA-NSynonyms
97432-30-93hydroxy55dimethyl2(9Hxanthen9yl)cyclohex2en1one
3hydroxy55dimethyl2(9Hxanthen9yl)cyclohex2enone
97432309
CC1(CC(=C(C(=O)C1)C2C3=CC=CC=C3OC4=CC=CC=C24)O)C
InChI=1SC21H20O3c121(2)1115(22)20(16(23)1221)1913735917(13)24181064814(18)19h3101922H1112H212H3
MFCD01857317
ZINC000100701130
ZINC100701130
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