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Compound: 5546
Plants: 312
References: 992
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14-Hydroxy-delta-cadinene
ScientificNameLabel
14-Hydroxy-delta-cadinene
PHCD compound ID :
1611
Chemical Names :
14-hydroxyd-delta-cadinene , 14-Hydroxy-delta-cadinene
Molecular Formula :
C15H24O1
Molecular Weight :
220.182715
More Details :
Names & Synonyms:
(8-isopropyl-5-methyl-3,4,6,7,8,8a-hexahydronaphthalen-2-yl)methanol , (5-methyl-8-propan-2-yl-3,4,6,7,8,8a-hexahydronaphthalen-2-yl)methanol
Smiles:
OCC1=C[C@@H]2C(=C(C)CC[C@H]2C(C)C)CC1
InChi :
InChI=1S/C15H24O/c1-10(2)13-6-4-11(3)14-7-5-12(9-16)8-15(13)14/h8,10,13,15-16H,4-7,9H2,1-3H3/t13-,15-/m0/s1
InChi Key :
InChIKey=PSCGCYQLAZATGE-ZFWWWQNUSA-N
PubChem ID :
14845381
Rotatable bond count :
2
Rule of five :
0
Hydrogen bond acceptor count :
1
Ionization potential :
8.891135
Hydrogen bond donor count :
1
Electric dipole moment :
1.997
XLogP :
3.579
VDW volume :
246.80062
Molecular weight :
220.182715
HOMO-LUMO gap :
9.924000
Herb list :
- Eryngium campestre - زول، بوقناق
Hyssop - Hyssopus angustifolius - زوفا
Yarrow - Achillea millefolium - بومادران
Refrences & Litretures:
179. Journal:'Journal of Essential Oil Research' Year:'1998' Volume:'10' Page:'427' DOI:'10.1080/10412905.1998.9700934' Title:'Chemical Composition of the Leaf Oil of Achillea millefolium L. Grown in Cuba'
395. Journal:'Journal of Essential Oil Bearing Plants' Year:'2009' Volume:'12' Page:'111' DOI:'10.1080/0972060X.2009.10643700' Title:'Chemical Composition and Antimicrobial Activity of Essential Oil of Hyssopus angustifolius M.B'
905. Journal:'Natural Product Communications' Year:'2008' Volume:'3' Page:'1121' DOI:'10.1177/1934578X0800300716' Title:'Essential Oil Composition of Eryngium campestre L. Growing in Different Soil Types. A Preliminary Study'
907. Journal:'Chem. Biodiversity' Year:'2017' Volume:'14' Page:'e1700096' DOI:'10.1002/cbdv.201700096' Title:'Cytotoxic Essential Oils from Eryngium campestre and Eryngium amethystinum (Apiaceae) Growing in Central Italy'
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