Vitas-M small molecule compound
4'-tert-butyl-11-hydroxy-7-methyl-1,2,3,4,10,11-hexahydro-5H-spiro[benzo[c]pyrano[3,2-g]chromene-9,1'-cyclohexan]-5-one
Catalog ID
STK717524
SMILES OC1C[C@@]2(CCC(CC2)C(C)(C)C)Oc2c1cc1c(c2C)oc(=O)c2c1CCCC2
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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 C26H34O4 MW 410.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H34O4/c1-15-22-19(17-7-5-6-8-18(17)24(28)29-22)13-20-21(27)14-26(30-23(15)20)11-9-16(10-12-26)25(2,3)4/h13,16,21,27H,5-12,14H2,1-4H3/t16?,21?,26-InChIKey
MLWZAIKAVMTMAQ-NPQMFRQKSA-NSynonyms
4(tertbutyl)11hydroxy7methyl341011tetrahydro1Hspiro(benzo(c)pyrano(32g)chromene91cyclohexan)5(2H)one
4tertbutyl11hydroxy7methyl12341011hexahydro5Hspiro(benzo(c)pyrano(32g)chromene91cyclohexan)5one
OC1C(C@@)2(CCC(CC2)C(C)(C)C)Oc2c1cc1c(c2C)oc(=O)c2c1CCCC2
OC1CC2(CCC(CC2)C(C)(C)C)Oc2c1cc1c(c2C)oc(=O)c2c1CCCC2
ZINC000009418888
ZINC000009418889
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