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Compound: 5546
Plants: 312
References: 992
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Methyl-n-tricosanoate
ScientificNameLabel
Methyl-n-tricosanoate
PHCD compound ID :
2080
Chemical Names :
Methyl-n-tricosanoate , Tricosanoic acid, methyl ester(Tricosanoic acid) , Tricosanoic acid,methyl ester
Molecular Formula :
C24H48O2
Molecular Weight :
368.365431
More Details :
Names & Synonyms:
methyl tricosanoate , tricosanoic acid methyl ester
Smiles:
CCCCCCCCCCCCCCCCCCCCCCC(=O)OC
InChi :
InChI=1S/C24H48O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26-2/h3-23H2,1-2H3
InChi Key :
InChIKey=VORKGRIRMPBCCZ-UHFFFAOYSA-N
PubChem ID :
75519
Rotatable bond count :
22
Rule of five :
2
Hydrogen bond acceptor count :
2
Ionization potential :
10.695250
Hydrogen bond donor count :
0
Electric dipole moment :
1.893
XLogP :
11.874
VDW volume :
438.604084
Molecular weight :
368.365431
HOMO-LUMO gap :
11.863000
Herb list :
Red pepper - Capsicum annuum - فلفل قرمز
Tamarind, Indian date - Tamarindus indica - تمرهندی
White mallow, Marsh-mallow - Althaea officinalis - ختمی
Refrences & Litretures:
249. Journal:'Pak. J. Bot' Year:'2008' Volume:'40' Page:'2553' DOI:'' Title:'CHEMICAL CONSTITUENTS OF TAMARINDUS INDICA L. MEDICINAL PLANT IN SINDH'
299. Journal:'J. Med. Plants Res' Year:'2011' Volume:'5' Page:'6972' DOI:'' Title:'Chemical composition and antimicrobial activity of the flower and root hexane extracts of Althaea officinalis in Northwest Iran'
546. Journal:'Food Chemistry' Year:'2007' Volume:'102' Page:'1096' DOI:'10.1016/j.foodchem.2006.06.047' Title:'Chemical and biological variability of hot pepper fruits (Capsicum annuum var. acuminatum L.) in relation to maturity stage'
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