KNApSAcK Metabolite Information

input word = C00034185

Metabolite Information

Structural formula

Name

Quinic acid

Formula

C7H12O6

192.06338812

CAS RN

36413-60-2

C_ID

C00034185 ,

InChIKey

AAWZDTNXLSGCEK-QLAIBGQYNA-N

InChICode

InChI=1S/C7H12O6/c8-3-1-7(13,6(11)12)2-4(9)5(3)10/h3-5,8-10,13H,1-2H2,(H,11,12)/t3-,4-,5-,7-/m0/s1

SMILES

[C@H]1([C@H]([C@H](C[C@@](C1)(O)C(=O)O)O)O)O

Start Substs in Alk. Biosynthesis (Prediction)

Organism

Kingdom	Family	Species	Reference
Plantae	Apiaceae	Foeniculum vulgare	Ref.
Plantae	Asteraceae	Helianthus annuus	Ref.
Plantae	Caricaceae	Carica papaya	Ref.
Plantae	Combretaceae	Terminalia chebula	Ref.
Plantae	Cruciferae	Arabidopsis thaliana	Ref.
Plantae	Cruciferae	Brassica oleracea var. italica	Ref.
Plantae	Fabaceae	Lotus japonicus	Ref.
Plantae	Ginkgoaceae	Ginkgo biloba	Ref.
Plantae	Lythraceae	Punica granatum	Ref.
Plantae	Magnoliaceae	Magnolia denudata	Ref.
Plantae	Magnoliaceae	Magnolia liliiflora	Ref.
Plantae	Moraceae	Ficus carica	Ref.
Plantae	Poaceae	Triticum aestivum	Ref.
Plantae	Rosaceae	Prunus avium	Ref.
Plantae	Rosaceae	Prunus persica	Ref.
Plantae	Rosaceae	Rosa rugosa	Ref.
Plantae	Rubiaceae	Cinchona ledgariana	Ref.
Plantae	Rutaceae	Citrus limon	Ref.
Plantae	Rutaceae	Citrus natsudaidai	Ref.
Plantae	Rutaceae	Citrus unshiu	Ref.
Plantae	Sapotaceae	Sebertia acuminata	Ref.
Plantae	Solanaceae	Nicotiana tabacum	Ref.
Plantae	Solanaceae	Solanum habrochaites	Ref.
Plantae	Solanaceae	Solanum lycopersicum	Ref.
Plantae	Solanaceae	Solanum neorickii	Ref.
Plantae	Solanaceae	Solanum parviflorum	Ref.
Plantae	Solanaceae	Solanum pennellii	Ref.
Plantae	Solanaceae	Solanum pimpinellifollium	Ref.
Plantae	Solanaceae	Solanum tuberosum	Ref.
Plantae	Taxaceae	Taxus baccata	Ref.
Plantae	Urticaceae	Urtica dioica	Ref.
Plantae	Vitaceae	Vitis vinifera	Ref.
-	-	Eucaliptus citriodora	Ref.

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Organism

Urtica dioica

Reference

Yin, et al., Modern Study of Chinese Drugs and Clinical Applications (1), Xueyuan Press, Beijing, (1993).

Edited by Jiangsu New Medicinal College, Chinese Medicine Dictionary, Shanghai Science and technology Press, Shanghai, (1979).

Sun, et al., Brief Handbook of Natural Active Compounds, Medicinal Science and Technology Press of China, Beijing, (1998).

Chinese Materia Medica Editing Committee of the National Chinese Medicine and Pharmacology Bureau, Chinese Materia Medica (ZHONG HUA BEN CAO), Vol.1-Vol.30, Shanghai Science and technology Press, Shanghai, (1999)