Vitas-M small molecule compound
3-(2,5-dimethoxyphenyl)-9-(octahydro-2H-quinolizin-1-ylmethyl)-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Catalog ID
STL477315
SMILES COc1ccc(cc1c1cc2ccc3c(c2oc1=O)CN(CO3)CC1CCCN2C1CCCC2)OC
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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/c1-33-21-9-11-26(34-2)22(15-21)23-14-19-8-10-27-24(28(19)36-29(23)32)17-30(18-35-27)16-20-6-5-13-31-12-4-3-7-25(20)31/h8-11,14-15,20,25H,3-7,12-13,16-18H2,1-2H3InChIKey
RFHPIVVDFZNQKA-UHFFFAOYSA-NSynonyms
3(25dimethoxyphenyl)9(((1S9aR)octahydro1Hquinolizin1yl)methyl)910dihydrochromeno(87e)(13)oxazin2(8H)one
3(25dimethoxyphenyl)9(octahydro2Hquinolizin1ylmethyl)910dihydro2H8Hchromeno(87e)(13)oxazin2one
9(23467899aoctahydro1Hquinolizin1ylmethyl)3(25dimethoxyphenyl)810dihydropyrano(23f)(13)benzoxazin2one
COC1=CC(=C(C=C1)OC)C2=CC3=C(C4=C(C=C3)OCN(C4)CC5CCCN6C5CCCC6)OC2=O
COc1ccc(cc1c1cc2ccc3c(c2oc1=O)CN(CO3)C(C@@H)1CCCN2(C@@H)1CCCC2)OC
InChI=1SC29H34N2O5c1332191126(342)22(1521)2314198102724(28(19)3629(23)32)1730(183527)16206513311243725(20)31h81114152025H3712131618H212H3
MFCD31750849
ZINC000020761072
ZINC000334161017
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