Vitas-M small molecule compound
7-(benzyloxy)-3-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-4,8-dimethyl-2H-chromen-2-one
Catalog ID
STL541792
SMILES O=C(N1CCC2(C(C1)CCCC2)O)CCc1c(=O)oc2c(c1C)ccc(c2C)OCc1ccccc1
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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 C30H35NO5 MW 489.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H35NO5/c1-20-24-11-13-26(35-19-22-8-4-3-5-9-22)21(2)28(24)36-29(33)25(20)12-14-27(32)31-17-16-30(34)15-7-6-10-23(30)18-31/h3-5,8-9,11,13,23,34H,6-7,10,12,14-19H2,1-2H3InChIKey
XWJHVXOLYFNZRI-UHFFFAOYSA-NSynonyms
3(3(4~(a)hydroxy13456788~(a)octahydroisoquinolin2yl)3oxopropyl)48dimethyl7phenylmethoxychromen2one
4557097
7(benzyloxy)3(3(4ahydroxyoctahydroisoquinolin2(1H)yl)3oxopropyl)48dimethyl2Hchromen2one
InChI=1SC30H35NO5c12024111326(3519228435922)21(2)28(24)3629(33)25(20)121427(32)31171630(34)15761023(30)1831h358911132334H6710121419H212H3
MFCD31755439
ZINC000002111083
ZINC000015954751
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