Vitas-M small molecule compound

N-(2-methylpropyl)-4-{[(4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy]acetyl}-1-phenylcyclohexanecarboxamide

Catalog ID
STK645762
SMILES CC(CNC(=O)C1(CCC(CC1)C(=O)COc1ccc2c(c1)oc(=O)c1c2CCC1)c1ccccc1)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 C31H35NO5 MW 501.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H35NO5/c1-20(2)18-32-30(35)31(22-7-4-3-5-8-22)15-13-21(14-16-31)27(33)19-36-23-11-12-25-24-9-6-10-26(24)29(34)37-28(25)17-23/h3-5,7-8,11-12,17,20-21H,6,9-10,13-16,18-19H2,1-2H3,(H,32,35)
InChIKey
BMJHSIOFZFURTC-UHFFFAOYSA-N
Synonyms
921052-86-0
921052860
CC(C)CNC(=O)C1(CCC(CC1)C(=O)COC2=CC3=C(C=C2)C4=C(CCC4)C(=O)O3)C5=CC=CC=C5
InChI=1SC31H35NO5c120(2)183230(35)31(227435822)151321(141631)27(33)19362311122524961026(24)29(34)3728(25)1723h35781112172021H691013161819H212H3(H3235)
MFCD08750022
N(2methylpropyl)4(((4oxo1234tetrahydrocyclopenta(c)chromen7yl)oxy)acetyl)1phenylcyclohexanecarboxamide
N(2methylpropyl)4(2((4oxo23dihydro1Hcyclopenta(c)chromen7yl)oxy)acetyl)1phenylcyclohexane1carboxamide
Nisobutyl4(2((4oxo1234tetrahydrocyclopenta(c)chromen7yl)oxy)acetyl)1phenylcyclohexanecarboxamide
ZINC000013653538
ZINC13653538

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.