Vitas-M small molecule compound
3-(3,4-dimethoxyphenyl)-9-(octahydro-2H-quinolizin-1-ylmethyl)-9,10-dihydro-4H,8H-chromeno[8,7-e][1,3]oxazin-4-one
Catalog ID
STL466708
SMILES COc1cc(ccc1OC)c1coc2c(c1=O)ccc1c2CN(CO1)CC1CCCN2C1CCCC2
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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 C29H34N2O5 MW 490.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N2O5/c1-33-26-10-8-19(14-27(26)34-2)23-17-35-29-21(28(23)32)9-11-25-22(29)16-30(18-36-25)15-20-6-5-13-31-12-4-3-7-24(20)31/h8-11,14,17,20,24H,3-7,12-13,15-16,18H2,1-2H3InChIKey
LCHPQVANSHXVPE-UHFFFAOYSA-NSynonyms
3(34dimethoxyphenyl)9(((1S9aR)octahydro1Hquinolizin1yl)methyl)910dihydrochromeno(87e)(13)oxazin4(8H)one
3(34dimethoxyphenyl)9(octahydro2Hquinolizin1ylmethyl)910dihydro4H8Hchromeno(87e)(13)oxazin4one
9(23467899aoctahydro1Hquinolizin1ylmethyl)3(34dimethoxyphenyl)810dihydropyrano(23f)(13)benzoxazin4one
COC1=C(C=C(C=C1)C2=COC3=C(C2=O)C=CC4=C3CN(CO4)CC5CCCN6C5CCCC6)OC
COc1cc(ccc1OC)c1coc2c(c1=O)ccc1c2CN(CO1)C(C@@H)1CCCN2(C@@H)1CCCC2
InChI=1SC29H34N2O5c1332610819(1427(26)342)2317352921(28(23)32)9112522(29)1630(183625)15206513311243724(20)31h81114172024H371213151618H212H3
MFCD31750925
ZINC000020762311
ZINC000229711447
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