Vitas-M small molecule compound
1-[(9Z)-9-(1,3-benzodioxol-5-ylmethylidene)-9H-fluoren-2-yl]-5-(piperidin-1-yl)pentan-1-one
Catalog ID
STK671461
SMILES O=C(c1ccc2c(c1)/C(=C\c1ccc3c(c1)OCO3)/c1c2cccc1)CCCCN1CCCCC1
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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 C31H31NO3 MW 465.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31NO3/c33-29(10-4-7-17-32-15-5-1-6-16-32)23-12-13-26-24-8-2-3-9-25(24)27(28(26)20-23)18-22-11-14-30-31(19-22)35-21-34-30/h2-3,8-9,11-14,18-20H,1,4-7,10,15-17,21H2/b27-18-InChIKey
JHSDAYRDRGDIQU-IMRQLAEWSA-NSynonyms
1((9Z)9(13benzodioxol5ylmethylidene)9Hfluoren2yl)5(piperidin1yl)pentan1one
1((9Z)9(13BENZODIOXOL5YLMETHYLIDENE)FLUOREN2YL)5PIPERIDIN1YLPENTAN1ONE
C1CCN(CC1)CCCCC(=O)C2=CC3=C(C=C2)C4=CC=CC=C4C3=CC5=CC6=C(C=C5)OCO6
InChI=1SC31H31NO3c3329(10471732155161632)2312132624823925(24)27(28(26)2023)182211143031(1922)35213430h238911141820H14710151721H2b2718
MFCD00819580
O=C(c1ccc2c(c1)C(=Cc1ccc3c(c1)OCO3)c1c2cccc1)CCCCN1CCCCC1
ZINC000012360523
ZINC12360523
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