Vitas-M small molecule compound
methyl 2-{[(4-butyl-6-chloro-2-oxo-2H-chromen-7-yl)oxy]acetyl}-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylate
Catalog ID
STL533265
SMILES CCCCc1cc(=O)oc2c1cc(Cl)c(c2)OCC(=O)N1Cc2[nH]c3c(c2CC1C(=O)OC)cccc3
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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 C28H27ClN2O6 MW 522.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27ClN2O6/c1-3-4-7-16-10-27(33)37-24-13-25(20(29)11-18(16)24)36-15-26(32)31-14-22-19(12-23(31)28(34)35-2)17-8-5-6-9-21(17)30-22/h5-6,8-11,13,23,30H,3-4,7,12,14-15H2,1-2H3InChIKey
QNQXIMBSSPETOS-UHFFFAOYSA-NSynonyms
(S)methyl2(2((4butyl6chloro2oxo2Hchromen7yl)oxy)acetyl)2349tetrahydro1Hpyrido(34b)indole3carboxylate
4435718
CCCCc1cc(=O)oc2c1cc(Cl)c(c2)OCC(=O)N1Cc2(nH)c3c(c2C(C@H)1C(=O)OC)cccc3
InChI=1SC28H27ClN2O6c1347161027(33)37241325(20(29)1118(16)24)361526(32)31142219(1223(31)28(34)352)17856921(17)3022h56811132330H347121415H212H3
methyl2(((4butyl6chloro2oxo2Hchromen7yl)oxy)acetyl)2349tetrahydro1Hbetacarboline3carboxylate
methyl2(2(4butyl6chloro2oxochromen7yl)oxyacetyl)1349tetrahydropyrido(34b)indole3carboxylate
MFCD31754005
ZINC000002150128
ZINC000009034013
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