Vitas-M small molecule compound
6'-butyl-4'-hydroxy-10'-methyl-3',4'-dihydro-8'H-spiro[cyclohexane-1,2'-pyrano[3,2-g]chromen]-8'-one
Catalog ID
STL234128
SMILES CCCCc1cc(=O)oc2c1cc1C(O)CC3(Oc1c2C)CCCCC3
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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 C22H28O4 MW 356.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28O4/c1-3-4-8-15-11-19(24)25-20-14(2)21-17(12-16(15)20)18(23)13-22(26-21)9-6-5-7-10-22/h11-12,18,23H,3-10,13H2,1-2H3InChIKey
CAFHUUPOVJAMRW-UHFFFAOYSA-NSynonyms
1013753-25-71013753257
6butyl4hydroxy10methyl34dihydro8Hspiro(cyclohexane12pyrano(32g)chromen)8one
6butyl4hydroxy10methyl3Hspiro(cyclohexane12pyrano(32g)chromen)8(4H)one
6butyl4hydroxy10methylspiro(34dihydropyrano(32g)chromene21cyclohexane)8one
CCCCC1=CC(=O)OC2=C(C3=C(C=C12)C(CC4(O3)CCCCC4)O)C
InChI=1SC22H28O4c1348151119(24)252014(2)2117(1216(15)20)18(23)1322(2621)96571022h11121823H31013H212H3
MFCD09849651
ZINC000013682680
ZINC000013682684
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