KNApSAcK Metabolite Information

input word = C00002682

Metabolite Information

Structural formula

Name

Vanillic acid
3-Methoxy-4-hydroxybenzoic acid

Formula

C8H8O4

168.04225874

CAS RN

121-34-6

C_ID

C00002682 ,

InChIKey

WKOLLVMJNQIZCI-UHFFFAOYSA-N

InChICode

InChI=1S/C8H8O4/c1-12-7-4-5(8(10)11)2-3-6(7)9/h2-4,9H,1H3,(H,10,11)

SMILES

c1(c(cc(cc1)C(=O)O)OC)O

Start Substs in Alk. Biosynthesis (Prediction)

Organism

Kingdom	Family	Species	Reference
Animalia	Hominidae	Homo sapiens (Urine)	Ref.
Bacteria	Pseudomonadaceae	Pseudomonas pseudoalcaligenes	Ref.
Bacteria	Streptomycetaceae	Streptomyces sp. GW23/1540	Ref.
Plantae	Acanthaceae	Dicliptera riparia	Ref.
Plantae	Alliaceae	Allium Sativum	Ref.
Plantae	Amaranthaceae	Gomphrena celosioides	Ref.
Plantae	Anacardiaceae	Mangifera indica	Ref.
Plantae	Apiaceae	Falcaria vulgaris	Ref.
Plantae	Apiaceae	Glehnia littoralis	Ref.
Plantae	Apiaceae	Notopterygium incisum	Ref.
Plantae	Apocynaceae	Catharanthus roseus	Ref.
Plantae	Apocynaceae	Trachelospermum asiaticum	Ref.
Plantae	Araliaceae	Panax ginseng	Ref.
Plantae	Aristolochiaceae	Aristolochia manshuriensis	Ref.
Plantae	Aristolochiaceae	Aristolochia pubescens	Ref.
Plantae	Asteraceae	Cichorium intybus	Ref.
Plantae	Asteraceae	Grindelia aphanactis	Ref.
Plantae	Asteraceae	Matricaria chamomilla	Ref.
Plantae	Asteraceae	Rhaponticum carthamoides	Ref.
Plantae	Asteraceae	Taraxacum formosanum	Ref.
Plantae	Begoniaceae	Begonia nantoensis	Ref.
Plantae	Betulaceae	Alnus japonica	Ref.
Plantae	Bignoniaceae	Paratecoma koraiensis	Ref.
Plantae	Cactaceae	Opuntia dillenii	Ref.
Plantae	Cannabaceae	Humulus lupulus	Ref.
Plantae	Caricaceae	Carica papaya	Ref.
Plantae	Celastraceae	Microtropis fokienensis	Ref.
Plantae	Celastraceae	Microtropis japonica	Ref.
Plantae	Convallariaceae	Tupistra chinensis	Ref.
Plantae	Cruciferae	Arabidopsis thaliana	Ref.
Plantae	Cucurbitaceae	Trichosanthes kirilowii	Ref.
Plantae	Cymodoceaceae	Amphibolis antarctica	Ref.
Plantae	Cymodoceaceae	Amphibolis griffithii	Ref.
Plantae	Cymodoceaceae	Cymodocea rotundata	Ref.
Plantae	Cymodoceaceae	Cymodocea serrulata	Ref.
Plantae	Cymodoceaceae	Halodule uninervis	Ref.
Plantae	Cymodoceaceae	Halodule wrightii	Ref.
Plantae	Cymodoceaceae	Syringodium filiforme	Ref.
Plantae	Cymodoceaceae	Syringodium isoetifolium	Ref.
Plantae	Cymodoceaceae	Thalassodendron ciliatum	Ref.
Plantae	Cyperaceae	Cyperus rotundus L.	Ref.
Plantae	Dipsacaceae/Diervillaceae/Linnaeaceae/Valerianaceae	Dipsacus asper	Ref.
Plantae	Elaeagnaceae	Elaeagnus pungens	Ref.
Plantae	Ephedraceae	Ephedra equisetina	Ref.
Plantae	Ericaceae	Erica australis	Ref.
Plantae	Eriocaulaceae	Eriocaulon buergerianum	Ref.
Plantae	Euphorbiaceae	Cleidion spiciflorum (Burm. f.) Merr.	Ref.
Plantae	Fabaceae	Amburana cearensis	Ref.
Plantae	Fabaceae	Derris scandens	Ref.
Plantae	Fabaceae	Medicago sativa	Ref.
Plantae	Fabaceae	Melilotus messanensis	Ref.
Plantae	Fabaceae	Pterocarpus santalinus	Ref.
Plantae	Geraniaceae	Pelargonium reniforme	Ref.
Plantae	Hydrangeaceae	Hydrangea chinensis	Ref.
Plantae	Hydrocharitaceae	Halophila engelmannii	Ref.
Plantae	Hydrocharitaceae	Halophila hawaiiana	Ref.
Plantae	Hydrocharitaceae	Thalassia hemprichii	Ref.
Plantae	Hydrocharitaceae	Thalassia testudinum	Ref.
Plantae	Iridaceae	Crocus sativus	Ref.
Plantae	Juglandaceae	Engelhardia roxburghiana	Ref.
Plantae	Labiatae	Ajuga taiwanensis	Ref.
Plantae	Labiatae	Callicarpa integerrima	Ref.
Plantae	Labiatae	Salvia officinalis	Ref.
Plantae	Lauraceae	Cinnamomum philippinense	Ref.
Plantae	Lauraceae	Cinnamomum subavenium MIQ.	Ref.
Plantae	Lythraceae	Punica granatum	Ref.
Plantae	Magnoliaceae	Magnolia denudata	Ref.
Plantae	Magnoliaceae	Magnolia liliiflora	Ref.
Plantae	Malvaceae	Gossypium mexicanum	Ref.
Plantae	Malvaceae	Hibiscus taiwanensis	Ref.
Plantae	Meliaceae	Melia azedarach	Ref.
Plantae	Meliaceae	Toona ciliata	Ref.
Plantae	Moraceae	Ficus septica	Ref.
Plantae	Orchidaceae	Gymnadenia conopsea R.BR.	Ref.
Plantae	Oxalidaceae	Oxalis corniculata	Ref.
Plantae	Paeoniaceae	Paeonia hybrida	Ref.
Plantae	Pinaceae	Picea ajanensis	Ref.
Plantae	Pinaceae	Picea obovata	Ref.
Plantae	Pinaceae	Pinus sibirica	Ref.
Plantae	Pinaceae	Pseudolarix kaempferi Gord.	Ref.
Plantae	Piperaceae	Peperomia duclouxii C. DC.	Ref.
Plantae	Piperaceae	Peperomia sui	Ref.
Plantae	Plantaginaceae	Picrorhiza kurrooa	Ref.
Plantae	Plantaginaceae	Picrorhiza kurrosa	Ref.
Plantae	Plantaginaceae	Plantago lanceolata	Ref.
Plantae	Plantaginaceae	Plantago major	Ref.
Plantae	Plantaginaceae	Plantago media	Ref.
Plantae	Plantaginaceae	Veronica peregrina L.	Ref.
Plantae	Plumbaginaceae	Ceratostigma willmottianum	Ref.
Plantae	Poaceae	Oryza sativa cv. Heugjinjubyeo	Ref.
Plantae	Poaceae	Triticum aestivum	Ref.
Plantae	Poaceae	Zea mays L.	Ref.
Plantae	Polytrichaceae	Polytrichum commune	Ref.
Plantae	Posidoniaceae	Posidonia australis	Ref.
Plantae	Posidoniaceae	Posidonia oceanica	Ref.
Plantae	Ranunculaceae	Ranunculus baudotii	Ref.
Plantae	Rhamnaceae	Colubrina faralaotra subsp.trichocarpa.	Ref.
Plantae	Rosaceae	Prunus avium	Ref.
Plantae	Rosaceae	Rosa canina	Ref.
Plantae	Rosaceae	Spiraea formosana	Ref.
Plantae	Rubiaceae	Rubia yunnanensis	Ref.
Plantae	Rutaceae	Citrus sudachi	Ref.
Plantae	Rutaceae	Fagara spp.	Ref.
Plantae	Rutaceae	Fagara tessmannii Engl.	Ref.
Plantae	Rutaceae	Phellodendron amurense var.wilsonii	Ref.
Plantae	Rutaceae	Phellodendron japonicum MAXIM	Ref.
Plantae	Rutaceae	Zanthoxylum simulans	Ref.
Plantae	Salicaceae	Populus pseudosimonii	Ref.
Plantae	Samydaceae	Casearia membranacea	Ref.
Plantae	Santalaceae	Viscum coloratum	Ref.
Plantae	Sapindaceae	Acer nikoense	Ref.
Plantae	Sarcolaenaceae	Leptolaena diospyroidea	Ref.
Plantae	Sarcolaenaceae	Leptolaena pauciflora	Ref.
Plantae	Simaroubaceae	Ailanthus integrifolia	Ref.
Plantae	Solanaceae	Hyoscyamus niger	Ref.
Plantae	Solanaceae	Solanum tuberosum	Ref.
Plantae	Taxaceae	Taxus baccata	Ref.
Plantae	Trochodendraceae/Tetracentraceae	Tetracentron sinense	Ref.
Plantae	Typhaceae/Sparganiaceae	Sparganium stoloniferum	Ref.
Plantae	Vittariaceae	Vittaria anguste-elongata	Ref.
Plantae	Zingiberaceae	Curcuma domestica	Ref.
Plantae	Zosteraceae	Phyllospadix scouleri	Ref.
Plantae	Zosteraceae	Phyllospadix serrulatus	Ref.
Plantae	Zosteraceae	Zostera marina	Ref.
-	-	Aganosma caryophyllata	Ref.
-	-	Equsetum arvense	Ref.
-	-	FOOD SAKE	Ref.
-	-	Lentinula edodes	Ref.
-	-	Opunitia dillenii HAW.	Ref.
-	-	Picrorrhiza scrophulariaeflora	Ref.
-	-	Picrorrhiza scrophulariiflora	Ref.
-	-	Sarcolaeana multiflora	Ref.
-	-	Scrophularis sambucifolia	Ref.

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Organism

Hyoscyamus niger

Reference

Xiao, et al., CCMM, 19, (1994), 421.

Buckingham(Executive Editor), Dictionary of Natural Products, Chapman & Hall, 1994, Vol1-7

1995, Vol8

1996, Vol9

1997, Vol10

1998, Vol11.

Wu, et al., Chem Pharm Bull, 53, (2005), 56.

YUAN, et al., Chem Pharm Bull, 50, (2002), 73.

QIU, et al., Chem Pharm Bull, 50, (2002), 1507.

MORIKAWA, et al., Chem Pharm Bull, 51, (2003), 62.

TAO, et al., Chem Pharm Bull, 51, (2003), 654.

CHAN, et al., Chem Pharm Bull, 53, (2005), 836.

LEU, et al., Chem Pharm Bull, 53, (2005), 853.

CHIU, et al., Chem Pharm Bull, 53, (2005), 1118.

Ma, et al., JNP, 65, (2002), 206.

Pan, et al., JNP, 66, (2003), 161.

Morikawa, et al., JNP, 66, (2003), 638.

Wu, et al., JNP, 66, (2003), 996.

Wu, et al., JNP, 66, (2003), 1207.

Chang, et al., Planta Med, 69, (2003), 667.

Ou, et al., Brief Handbook of Components of Traditional Chinese Medicines, The People's Medical Publishing House, Beijing, (2003).

Chen, Liu, et al., Determination of Effective Components in Traditional Chinese medicines, People's Medical Publishing House, Beijing, (2009)