input word = C00001136

Metabolite InformationStructural formula
Name Lactose
Formula C12H22O11
Mw 342.11621155
CAS RN 63-42-3
C_ID C00001136 ,
InChIKey GUBGYTABKSRVRQ-QGENSXPJNA-N
InChICode InChI=1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3-,4+,5+,6-,7+,8-,9-,10-,11+,12-/m0/s1
SMILES [C@@H]1([C@@H]([C@@H]([C@@H](O[C@H]1CO)O[C@H]1[C@H](O[C@H]([C@H]([C@H]1O)O)O)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaHominidaeHomo sapiens (Urine) Ref.
PlantaeFabaceaeCassia multijuga Ref.
PlantaeFabaceaeMedicago sativa Ref.
PlantaeOleaceaeForsythia spp. Ref.
PlantaeOleaceaeForsythia suspensa Ref.
PlantaePoaceaeTriticum aestivum Ref.
PlantaeRosaceaePrunus avium Ref.
PlantaeSapotaceaeAchras sapota Ref.
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OrganismPrunus avium
ReferenceKaragiannis, E. et al., Plant Physiol. Biochem., 127, (2018), 478-484.