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lucidin-O-ethyl ether
ScientificNameLabel
lucidin-O-ethyl ether
PHCD compound ID :
2868
Chemical Names :
lucidin-O-ethyl ether
Molecular Formula :
C17H14O5
Molecular Weight :
298.084124
More Details :
Names & Synonyms:
2-(ethoxymethyl)-1,3-dihydroxy-anthracene-9,10-dione , 2-(ethoxymethyl)-1,3-dihydroxyanthracene-9,10-dione , 2-(ethoxymethyl)-1,3-bis(oxidanyl)anthracene-9,10-dione , 2-(ethoxymethyl)-1,3-dihydroxy-9,10-anthraquinone
Smiles:
CCOCc1c(O)cc2c(c1O)C(=O)c1c(C2=O)cccc1
InChi :
InChI=1S/C17H14O5/c1-2-22-8-12-13(18)7-11-14(17(12)21)16(20)10-6-4-3-5-9(10)15(11)19/h3-7,18,21H,2,8H2,1H3
InChi Key :
InChIKey=VRARPPQMEQUQET-UHFFFAOYSA-N
PubChem ID :
28578
Rotatable bond count :
3
Rule of five :
0
Hydrogen bond acceptor count :
5
Ionization potential :
9.433497
Hydrogen bond donor count :
2
Electric dipole moment :
2.410
XLogP :
0.714
VDW volume :
266.578285
Molecular weight :
298.084124
HOMO-LUMO gap :
7.998000
Herb list :
Madder - Rubia tinctorum - روناس
Refrences & Litretures:
360. Journal:'Int J Adv Biol Biom Res' Year:'2013' Volume:'1' Page:'1315' DOI:'' Title:'Rubia tinctorum L. (Rubiaceae) or Madder as one of the living color to dyeing wool'
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