input word = C00030579

Metabolite InformationStructural formula
Name Kadsuralignan A
Formula C22H26O7
Mw 402.16785319
CAS RN 913237-64-6
C_ID C00030579 ,
InChIKey IHVGPKYZFAVXGZ-UHFFFAOYNA-N
InChICode InChI=1S/C22H26O7/c1-10-6-12-7-14(23)19(25-3)21(26-4)16(12)17-13(18(24)11(10)2)8-15-20(22(17)27-5)29-9-28-15/h7-8,10-11,18,23-24H,6,9H2,1-5H3/t10-,11-,18-/m1/s1
SMILES c12c([C@@H]([C@@H]([C@@H](Cc3c1c(c(c(c3)O)OC)OC)C)C)O)cc1c(c2OC)OCO1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSchisandraceaeKadsura coccinea Ref.
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OrganismKadsura coccinea
ReferenceLi,Chem.Pharm.Bull.,54,(2006),1022