Vitas-M small molecule compound
N-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethyl]-2-[(3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-1-yl)oxy]propanamide
Catalog ID
STL461155
SMILES Cc1cc(OC(C(=O)NCC(=O)N2CCC3(C(C2)CCCC3)O)C)c2c(c1)oc(=O)c1c2CCCC1
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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 C28H36N2O6 MW 496.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H36N2O6/c1-17-13-22(25-20-8-3-4-9-21(20)27(33)36-23(25)14-17)35-18(2)26(32)29-15-24(31)30-12-11-28(34)10-6-5-7-19(28)16-30/h13-14,18-19,34H,3-12,15-16H2,1-2H3,(H,29,32)InChIKey
PMSDGSYVHUPNDU-UHFFFAOYSA-NSynonyms
CC1=CC2=C(C3=C(CCCC3)C(=O)O2)C(=C1)OC(C)C(=O)NCC(=O)N4CCC5(CCCCC5C4)O
InChI=1SC28H36N2O6c1171322(2520834921(20)27(33)3623(25)1417)3518(2)26(32)291524(31)30121128(34)1065719(28)1630h1314181934H3121516H212H3(H2932)
MFCD10040820
N(2(4ahydroxy13456788aoctahydroisoquinolin2yl)2oxoethyl)2((3methyl6oxo78910tetrahydrobenzo(c)chromen1yl)oxy)propanamide
N(2(4ahydroxyoctahydroisoquinolin2(1H)yl)2oxoethyl)2((3methyl6oxo78910tetrahydro6Hbenzo(c)chromen1yl)oxy)propanamide
ZINC000002111878
ZINC000238923850
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