Vitas-M small molecule compound
3-{2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxoethyl}-4,8,8-trimethyl-7,8-dihydro-2H,6H-pyrano[3,2-g]chromen-2-one
Catalog ID
STK621466
SMILES Clc1ccc(cc1)C1(O)CCN(CC1)C(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)OC(CC1)(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 C28H30ClNO5 MW 496.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30ClNO5/c1-17-21-14-18-8-9-27(2,3)35-23(18)16-24(21)34-26(32)22(17)15-25(31)30-12-10-28(33,11-13-30)19-4-6-20(29)7-5-19/h4-7,14,16,33H,8-13,15H2,1-3H3InChIKey
MKDJWVGJYRTWGA-UHFFFAOYSA-NSynonyms
931212-65-63(2(4(4chlorophenyl)4hydroxypiperidin1yl)2oxoethyl)488trimethyl78dihydro2H6Hpyrano(32g)chromen2one
3(2(4(4chlorophenyl)4hydroxypiperidin1yl)2oxoethyl)488trimethyl78dihydropyrano(32g)chromen2(6H)one
7(2(4(4chlorophenyl)4hydroxypiperidin1yl)2oxoethyl)226trimethyl34dihydropyrano(32g)chromen8one
931212656
CC1=C(C(=O)OC2=CC3=C(CCC(O3)(C)C)C=C12)CC(=O)N4CCC(CC4)(C5=CC=C(C=C5)Cl)O
InChI=1SC28H30ClNO5c1172114188927(23)3523(18)1624(21)3426(32)22(17)1525(31)30121028(33111330)194620(29)7519h47141633H81315H213H3
ZINC000009341507
ZINC09341507
ZINC9341507
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