Vitas-M small molecule compound
N-(2-{[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethyl]amino}-2-oxoethyl)-2-[(7-methyl-2-oxo-4-propyl-2H-chromen-5-yl)oxy]propanamide
Catalog ID
STL004141
SMILES CCCc1cc(=O)oc2c1c(cc(c2)C)OC(C(=O)NCC(=O)NCC(=O)N1CCC2(C(C1)CCCC2)O)C
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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 C29H39N3O7 MW 541.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H39N3O7/c1-4-7-20-14-26(35)39-23-13-18(2)12-22(27(20)23)38-19(3)28(36)31-15-24(33)30-16-25(34)32-11-10-29(37)9-6-5-8-21(29)17-32/h12-14,19,21,37H,4-11,15-17H2,1-3H3,(H,30,33)(H,31,36)InChIKey
XAKSFGPHKQCSPF-UHFFFAOYSA-NSynonyms
CCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(C)C(=O)NCC(=O)NCC(=O)N3CCC4(CCCCC4C3)O
InChI=1SC29H39N3O7c147201426(35)39231318(2)1222(27(20)23)3819(3)28(36)311524(33)301625(34)32111029(37)965821(29)1732h1214192137H4111517H213H3(H3033)(H3136)
MFCD18185368
N(2((2(4ahydroxy13456788aoctahydroisoquinolin2yl)2oxoethyl)amino)2oxoethyl)2(7methyl2oxo4propylchromen5yl)oxypropanamide
N(2((2(4AHYDROXYOCTAHYDROISOQUINOLIN2(1H)YL)2OXOETHYL)AMINO)2OXOETHYL)2((7METHYL2OXO4PROPYL2HCHROMEN5YL)OXY)PROPANAMIDE
ZINC000002115761
ZINC000257173786
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