Vitas-M small molecule compound
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[3-(4-methoxyphenyl)-2-methyl-4-oxo-4H-chromen-7-yl]oxy}acetamide
Catalog ID
STL009327
SMILES COc1ccc(cc1)c1c(C)oc2c(c1=O)ccc(c2)OCC(=O)NCCC1=CCCCC1
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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 C27H29NO5 MW 447.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29NO5/c1-18-26(20-8-10-21(31-2)11-9-20)27(30)23-13-12-22(16-24(23)33-18)32-17-25(29)28-15-14-19-6-4-3-5-7-19/h6,8-13,16H,3-5,7,14-15,17H2,1-2H3,(H,28,29)InChIKey
RLOOMABPSPUHLG-UHFFFAOYSA-NSynonyms
CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=O)NCCC3=CCCCC3)C4=CC=C(C=C4)OC
InChI=1SC27H29NO5c11826(2081021(312)11920)27(30)23131222(1624(23)3318)321725(29)281514196435719h681316H357141517H212H3(H2829)
MFCD09848951
N(2(cyclohex1en1yl)ethyl)2((3(4methoxyphenyl)2methyl4oxo4Hchromen7yl)oxy)acetamide
N(2(cyclohexen1yl)ethyl)2(3(4methoxyphenyl)2methyl4oxochromen7yl)oxyacetamide
ZINC000009049970
ZINC09049970
ZINC9049970
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