Vitas-M small molecule compound
6'-methyl-7'-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-3',4'-dihydro-8'H-spiro[cyclohexane-1,2'-pyrano[3,2-g]chromen]-8'-one
Catalog ID
STL239372
SMILES O=C(N1CCN(CC1)c1ccccn1)Cc1c(=O)oc2c(c1C)cc1c(c2)OC2(CC1)CCCCC2
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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 C29H33N3O4 MW 487.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33N3O4/c1-20-22-17-21-8-11-29(9-4-2-5-10-29)36-24(21)19-25(22)35-28(34)23(20)18-27(33)32-15-13-31(14-16-32)26-7-3-6-12-30-26/h3,6-7,12,17,19H,2,4-5,8-11,13-16,18H2,1H3InChIKey
HVRCMJZMMAQTPF-UHFFFAOYSA-NSynonyms
1014403-85-01014403850
6methyl7(2oxo2(4(pyridin2yl)piperazin1yl)ethyl)34dihydro8Hspiro(cyclohexane12pyrano(32g)chromen)8one
6methyl7(2oxo2(4(pyridin2yl)piperazin1yl)ethyl)3Hspiro(cyclohexane12pyrano(32g)chromen)8(4H)one
6methyl7(2oxo2(4pyridin2ylpiperazin1yl)ethyl)spiro(34dihydropyrano(32g)chromene21cyclohexane)8one
CC1=C(C(=O)OC2=CC3=C(CCC4(O3)CCCCC4)C=C12)CC(=O)N5CCN(CC5)C6=CC=CC=N6
InChI=1SC29H33N3O4c12022172181129(94251029)3624(21)1925(22)3528(34)23(20)1827(33)32151331(141632)26736123026h367121719H245811131618H21H3
MFCD08748301
ZINC000009340786
ZINC9340786
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