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Compound: 5546
Plants: 312
References: 992
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15-Crown-5
ScientificNameLabel
15-Crown-5
PHCD compound ID :
5119
Chemical Names :
15-Crown-5
Molecular Formula :
C10H20O5
Molecular Weight :
220.131074
More Details :
Names & Synonyms:
1,4,7,10,13-pentaoxacyclopentadecane , 15-crown-5
Smiles:
O1CCOCCOCCOCCOCC1
InChi :
InChI=1S/C10H20O5/c1-2-12-5-6-14-9-10-15-8-7-13-4-3-11-1/h1-10H2
InChi Key :
InChIKey=VFTFKUDGYRBSAL-UHFFFAOYSA-N
PubChem ID :
36336
Rotatable bond count :
0
Rule of five :
0
Hydrogen bond acceptor count :
5
Ionization potential :
9.690351
Hydrogen bond donor count :
0
Electric dipole moment :
1.907
XLogP :
-0.95
VDW volume :
213.11098
Molecular weight :
220.131074
HOMO-LUMO gap :
11.629000
Herb list :
Wild celery, Celery - Apium graveolens - کرفس، کرفس وحشی
Refrences & Litretures:
806. Journal:'Immunopharmacology and Immunotoxicology' Year:'2012' Volume:'34' Page:'205' DOI:'10.3109/08923973.2011.592534' Title:'Chemical composition, antioxidant activity and larvicidal efects of essential oil from leaves of Apium graveolens'
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