input word = C00010604

Metabolite InformationStructural formula
Name Loganate
Loganic acid
Formula C16H24O10
Mw 376.13694699
CAS RN 22255-40-9
C_ID C00010604 ,
InChIKey JNNGEAWILNVFFD-MVRWXDQTNA-N
InChICode InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10-,11+,12-,13-,15-,16?/m0/s1
SMILES [C@H]12[C@@H]([C@@H](OC=C1C(=O)O)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@@H]1O)O)O)CO)[C@H]([C@H](C2)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
Plantae--Lonicera japonica Ref.
PlantaeApocynaceaeCatharanthus roseus Ref.
PlantaeApocynaceaeRauwolfia serpentina Ref.
PlantaeCornaceae/Aucubaceae/Garryaceae/HelwingiaceaeAlangium lamarckii Ref.
PlantaeCornaceae/Aucubaceae/Garryaceae/HelwingiaceaeCornus officinalis Ref.
PlantaeGentianaceaeCentaurium erythraea Ref.
PlantaeGentianaceaeFrasera caroliniensis Ref.
PlantaeGentianaceaeGentiana algida Ref.
PlantaeGentianaceaeGentiana crassicaulis Ref.
PlantaeGentianaceaeGentiana decumbers Ref.
PlantaeGentianaceaeGentiana lawrencei Ref.
PlantaeGentianaceaeGentiana loureirii Ref.
PlantaeGentianaceaeGentiana lutea Ref.
PlantaeGentianaceaeGentiana macrophylla Ref.
PlantaeGentianaceaeGentiana manshurica Ref.
PlantaeGentianaceaeGentiana officinalis Ref.
PlantaeGentianaceaeGentiana rhodantha Ref.
PlantaeGentianaceaeGentiana rigescens Ref.
PlantaeGentianaceaeGentiana scabra Ref.
PlantaeGentianaceaeGentiana straminea Ref.
PlantaeGentianaceaeGentiana triflora Ref.
PlantaeGentianaceaeSwertia carolinensis Ref.
PlantaeGentianaceaeSwertia davidii Ref.
PlantaeGentianaceaeTripterospermum japonicum Ref.
PlantaeLonganiaceaeStrychnos axillaris Ref.
PlantaeLonganiaceaeStrychnos lucida Ref.
PlantaeLonganiaceaeStrychnos nux-vomica Ref.
PlantaeOleaceaeFontanesia fortunei Carr. Ref.
PlantaeOleaceaeFontanesia phillyreoides Labill. Ref.
PlantaeOleaceaeOsmanthus austrocaledonicus (Vieill.) Knobl. Ref.
PlantaeOleaceaePicconia excelsa (Aiton) DC. Ref.
PlantaeRubiaceaeOphiorrhiza liukiuensis Ref.
PlantaeRubiaceaeSinoadina Racemosa Ref.
PlantaeScrophulariaceaeRehmannia glutinosa Ref.
PlantaeVerbenaceaeLippia graveolens Ref.
--Radix gentianae Ref.
--Sertia mussotii Ref.
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OrganismRehmannia glutinosa
ReferenceSun, P. et al., Int. J. Mol. Sci., 13, (2012), 13748-13763.