Structure

Rapanone

CAS
573-40-0
Catalog Number
ACM573400
Category
Inhibitors
Molecular Weight
322.44
Molecular Formula
C19H30O4

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Specification

Description
Rapanone is a natural benzoquinone. Rapanone exhibits a broad spectrum of biological actions, including anti-tumor, antioxidant, anti-inflammatory, antibacterial and antiparasitic. Rapanone also is a potent and selective human synovial PLA2 inhibitor, with an IC50 of 2.6 μM.
Synonyms
2,5-Dihydroxy-3-Tridecyl-1,4-Benzoquinone
IUPAC Name
2,5-dihydroxy-3-tridecylcyclohexa-2,5-diene-1,4-dione
Canonical SMILES
CCCCCCCCCCCCCC1=C(C(=O)C=C(C1=O)O)O
InChI
InChI=1S/C19H30O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18(22)16(20)14-17(21)19(15)23/h14,20,23H,2-13H2,1H3
InChI Key
AMKNOBHCKRZHIO-UHFFFAOYSA-N
Boiling Point
457 ºC at 760mmHg
Melting Point
142-145 ºC
Flash Point
244.3 ºC
Density
1.099 g/cm3
Exact Mass
322.21400
H-Bond Acceptor
4
H-Bond Donor
2
Refractive Index
1.53
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