beta Farnesene

Details

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Internal ID 70993e84-c656-4df5-b948-79f43fe32112
Taxonomy Lipids and lipid-like molecules > Prenol lipids > Sesquiterpenoids
IUPAC Name (6E)-2,6-dimethyl-10-methylidenedodeca-2,6-diene
SMILES (Canonical) CCC(=C)CCC=C(C)CCC=C(C)C
SMILES (Isomeric) CCC(=C)CC/C=C(\C)/CCC=C(C)C
InChI InChI=1S/C15H26/c1-6-14(4)10-8-12-15(5)11-7-9-13(2)3/h9,12H,4,6-8,10-11H2,1-3,5H3/b15-12+
InChI Key APAPGJJZPJQKJJ-NTCAYCPXSA-N
Popularity 410 references in papers

Physical and Chemical Properties

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Molecular Formula C15H26
Molecular Weight 206.37 g/mol
Exact Mass 206.203450829 g/mol
Topological Polar Surface Area (TPSA) 0.00 Ų
XlogP 6.20

Synonyms

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APAPGJJZPJQKJJ-NTCAYCPXSA-N
E78782

2D Structure

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2D Structure of beta Farnesene

3D Structure

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ADMET Properties (via admetSAR 2)

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Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

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Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL4769 O95749 Geranylgeranyl pyrophosphate synthetase 96.74% 92.08%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 87.67% 96.09%
CHEMBL2581 P07339 Cathepsin D 83.53% 98.95%
CHEMBL2107 P61073 C-X-C chemokine receptor type 4 82.49% 93.10%
CHEMBL3060 Q9Y345 Glycine transporter 2 80.30% 99.17%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
To see more specific details click the taxa you are interested in.
Abies nordmanniana
Ageratum conyzoides
Ambrosia trifida
Aniba puchury-minor
Arctotis arctotoides
Artemisia annua
Artemisia frigida
Artemisia lagocephala
Artemisia schmidtiana
Asarum fauriei
Asarum megacalyx
Austrobaileya scandens
Baccharis patagonica
Bedfordia arborescens
Blumea obliqua
Brickellia californica
Calea prunifolia
Cannabis sativa
Carapichea ipecacuanha
Castanopsis cuspidata
Chromolaena bigelovii
Citrus × aurantium
Cleistopholis patens
Clinopodium grandiflorum
Clinopodium serpyllifolium subsp. fruticosum
Conioselinum anthriscoides
Croton jacobinensis
Croton sonderianus
Cryptomeria japonica
Curcuma longa
Dacrydium nidulum
Daphne odora
Daucus carota
Dendropanax trifidus
Echinacea angustifolia
Encelia canescens
Erigeron philadelphicus
Haplopappus glutinosus
Hebeclinium macrophyllum
Helianthus tuberosus
Helichrysum cephaloideum
Heliopsis buphthalmoides
Humulus lupulus
Jacobaea erucifolia subsp. erucifolia
Lagoecia cuminoides
Larix gmelinii var. gmelinii
Lavandula latifolia
Leonotis leonurus
Mentha aquatica
Metacalypogeia alternifolia
Micromeria sinaica
Monticalia firmipes
Nepeta cataria
Nepeta nuda
Origanum majorana
Osmorhiza aristata
Pelargonium citronellum
Pentzia eenii
Perilla frutescens
Picea glehnii
Pinus sylvestris
Piper arboreum
Piper nigrum
Plagiochila ovalifolia
Plumeria rubra
Psiadia ceylanica
Pteronia eenii
Roldana sundbergii
Salvia aurea
Salvia sclarea
Santalum spicatum
Scapania undulata
Senecio lydenburgensis
Senecio squalidus
Senecio variabilis
Sericocarpus linifolius
Smallanthus uvedalia
Solanum tuberosum
Swertia japonica
Synedrella nodiflora
Tagetes lucida
Tanacetum annuum
Tanacetum parthenium
Thuja standishii
Ursinia trifida
Vitex agnus-castus
Warburgia stuhlmannii

Cross-Links

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PubChem 15228937
LOTUS LTS0154516
wikiData Q104247111