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ScientificNameLabel
Rhein
PHCD compound ID : 3294
Chemical Names :
Rhein
Molecular Formula : C15H8O6
Molecular Weight : 284.032088
More Details :
Names & Synonyms: 4,5-dihydroxy-9,10-dioxo-anthracene-2-carboxylic acid , 4,5-dihydroxy-9,10-dioxo-2-anthracenecarboxylic acid , 4,5-dihydroxy-9,10-dioxoanthracene-2-carboxylic acid , 4,5-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracene-2-carboxylic acid , 4,5-dihydroxy-9,10-diketo-anthracene-2-carboxylic acid
Smiles: Oc1cc(cc2c1C(=O)c1c(C2=O)cccc1O)C(=O)O
InChi : InChI=1S/C15H8O6/c16-9-3-1-2-7-11(9)14(19)12-8(13(7)18)4-6(15(20)21)5-10(12)17/h1-5,16-17H,(H,20,21)
InChi Key : InChIKey=FCDLCPWAQCPTKC-UHFFFAOYSA-N
PubChem ID : 10168
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 6 Ionization potential : 9.620498
Hydrogen bond donor count : 3 Electric dipole moment : 2.321
XLogP : -0.261 VDW volume : 238.140084
Molecular weight : 284.032088 HOMO-LUMO gap : 7.540000
Herb list :
Refrences & Litretures:
  
448.      Journal:'Indian Journal of Natural Products and Resources'      Year:'2010'      Volume:'3'      Page:'291'      DOI:''      Title:'A review on anthraquinones isolated from Cassia species and their applications'
547.      Journal:'J. Nat. Prod. Plant Resour'      Year:'2011'      Volume:'1'      Page:'101'      DOI:''      Title:'Cassia fistula Linn. (Amulthus)- An Important Medicinal Plant: A Review of Its Traditional Uses, Phytochemistry and Pharmacological Properties'
549.      Journal:'African Journal of Biotechnology'      Year:'2005'      Volume:'4'      Page:'1530'      DOI:''      Title:'Phytochemical constituents of Cassia fistula'
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