Vitas-M small molecule compound

8-(3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocin-1(6aH)-ylmethyl)-3-hexyl-7-hydroxy-4-methyl-2H-chromen-2-one

Catalog ID
STL511544
SMILES CCCCCCc1c(=O)oc2c(c1C)ccc(c2CN1CCCC2=CC3CC(C12)CN1CCCCC31)O

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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 C32H44N2O3 MW 504.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H44N2O3/c1-3-4-5-6-11-26-21(2)25-13-14-29(35)27(31(25)37-32(26)36)20-34-16-9-10-22-17-23-18-24(30(22)34)19-33-15-8-7-12-28(23)33/h13-14,17,23-24,28,30,35H,3-12,15-16,18-20H2,1-2H3
InChIKey
IKCUQBXWYWBLDL-UHFFFAOYSA-N
Synonyms

135638009
8(((6R6aR13R13aS)23466a78910121313adodecahydro1H613methanodipyrido(12a32e)azocin1yl)methyl)3hexyl7hydroxy4methyl2Hchromen2one
8(315diazatetracyclo(7710^(27)0^(1015))heptadec7en3ylmethyl)3hexyl7hydroxy4methylchromen2one
8(34678910121313adecahydro2H613methanodipyrido(12a32e)azocin1(6aH)ylmethyl)3hexyl7hydroxy4methyl2Hchromen2one
CCCCCCc1c(=O)oc2c(c1C)ccc(c2CN1CCCC2=C(C@H)3C(C@H)((C@H)12)CN1CCCC(C@H)31)O
InChI=1SC32H44N2O3c13456112621(2)25131429(35)27(31(25)3732(26)36)2034169102217231824(30(22)34)193315871228(23)33h1314172324283035H31215161820H212H3
MFCD31751690
ZINC000524729755
ZINC001614472438

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Available files

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