KNApSAcK Metabolite Information

input word = C00001231

Metabolite Information

Structural formula

Name

Octanoic acid
Caprylic acid
n-Octanoic acid

Formula

C8H16O2

144.11502975

CAS RN

124-07-2

C_ID

C00001231 ,

InChIKey

WWZKQHOCKIZLMA-UHFFFAOYSA-N

InChICode

InChI=1S/C8H16O2/c1-2-3-4-5-6-7-8(9)10/h2-7H2,1H3,(H,9,10)

SMILES

CCCCCCCC(=O)O

Start Substs in Alk. Biosynthesis (Prediction)

Organism

Kingdom	Family	Species	Reference
Bacteria	Enterobacteriaceae	Escherichia coli	Ref.
Fungi	Ganodermataceae	Ganoderma lucidum	Ref.
Plantae	Anacardiaceae	Mangifera indica	Ref.
Plantae	Apiaceae	Bupleurum chinense	Ref.
Plantae	Araliaceae	Panax quinquefolium	Ref.
Plantae	Asteraceae	Anthemis aciphylla BOISS.var.discoidea BOISS	Ref.
Plantae	Campanulaceae/Lobeliaceae	Codonopsis pilosula	Ref.
Plantae	Caricaceae	Carica papaya	Ref.
Plantae	Caryophyllaceae	Drymaria cordata	Ref.
Plantae	Clusiaceae/Clusiaceae-Guttiferae	Garcinia dulcis	Ref.
Plantae	Crassulaceae	Rhodiola rosea L.	Ref.
Plantae	Cruciferae	Arabidopsis thaliana	Ref.
Plantae	Cruciferae	Brassica hirta	Ref.
Plantae	Elaeagnaceae	Hippophae rhamnoides	Ref.
Plantae	Ginkgoaceae	Ginkgo biloba	Ref.
Plantae	Lythraceae	Cuphea painteri	Ref.
Plantae	Lythraceae	Punica granatum	Ref.
Plantae	Nymphaeaceae	Nymphaea alba	Ref.
Plantae	Palmae	Cocos nucifera	Ref.
Plantae	Pinaceae	Pinus sibirica	Ref.
Plantae	Rosaceae	Prunus avium	Ref.
Plantae	Santalaceae	Santalum album	Ref.
Plantae	Saxifragaceae	Saxifraga stolonifera Meerb.	Ref.
Plantae	Scrophulariaceae	Rehmannia glutinosa	Ref.
Plantae	Solanaceae	Nicotiana tabacum	Ref.
-	-	Caffea sp.	Ref.
-	-	FOOD SAKE	Ref.
-	-	Poria cocos	Ref.
-	-	Spongiporus leucomallellus (Murril)	Ref.

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Organism	Rehmannia glutinosa
Reference	Sun, et al., Brief Handbook of Natural Active Compounds, Medicinal Science and Technology Press of China, Beijing, (1998). Yin, et al., Modern Study of Chinese Drugs and Clinical Applications (1), Xueyuan Press, Beijing, (1993).