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Compound: 5546
Plants: 312
References: 992
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campholenal
ScientificNameLabel
campholenal
PHCD compound ID :
3887
Chemical Names :
campholenal , Campholenal
Molecular Formula :
C10H16O1
Molecular Weight :
152.120115
More Details :
Names & Synonyms:
2-[(1R)-2,2,3-trimethylcyclopent-3-en-1-yl]acetaldehyde , 2-[(1R)-2,2,3-trimethyl-1-cyclopent-3-enyl]acetaldehyde , 2-[(1R)-2,2,3-trimethylcyclopent-3-en-1-yl]ethanal
Smiles:
O=CC[C@H]1CC=C(C1(C)C)C
InChi :
InChI=1S/C10H16O/c1-8-4-5-9(6-7-11)10(8,2)3/h4,7,9H,5-6H2,1-3H3/t9-/m1/s1
InChi Key :
InChIKey=OGCGGWYLHSJRFY-SECBINFHSA-N
PubChem ID :
1252759
Rotatable bond count :
2
Rule of five :
0
Hydrogen bond acceptor count :
1
Ionization potential :
9.439481
Hydrogen bond donor count :
0
Electric dipole moment :
3.368
XLogP :
2.924
VDW volume :
172.677156
Molecular weight :
152.120115
HOMO-LUMO gap :
10.202000
Herb list :
Myrtle - Myrtus communis - مورد
Perovskia - Perovskia abrotanoides - برازمبل
St John's wort - Hypericum perforatum - گل راعی، هوفاریقون ، گل شهناز
Refrences & Litretures:
526. Journal:'Comptes Rendus Biologies' Year:'2002' Volume:'325' Page:'781' DOI:'' Title:'Composition of the essential oils of Hypericum perforatum L. from southeastern France'
698. Journal:'Journal of Essential Oil Research' Year:'2015' Volume:'27' Page:'465' DOI:'10.1080/10412905.2015.1065773' Title:'Chemical composition of essential oils of leaves and flowers from five cultivars of myrtle (Myrtus communis L.)'
766. Journal:'Journal of Herbal Drugs' Year:'2015' Volume:'6' Page:'59' DOI:'' Title:'Chemical composition of the volatile fraction of Perovskia abrotanoides and Nepeta glomerulosa growing wild in Iran by different extraction methods'
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