input word = C00039301

Metabolite InformationStructural formula
Name Gulsamanin
Formula C25H22O13
Mw 530.10604079
CAS RN 231298-74-1
C_ID C00039301 ,
InChIKey NOSNPRHQZMFYES-IPFBIQTINA-N
InChICode InChI=1S/C25H22O13/c1-34-13-7-10-6-11(27)18(29)17(23(10)38-24(13)33)16-12(4-2-9-3-5-15(28)37-22(9)16)35-25-21(32)20(31)19(30)14(8-26)36-25/h2-7,14,19-21,25-27,29-32H,8H2,1H3/t14-,19-,20+,21-,25-/m1/s1
SMILES COc1cc2cc(O)c(O)c(-c3c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)ccc4ccc(=O)oc34)c2oc1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeThymelaeaceaeDaphne oleoides Ref.
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OrganismDaphne oleoides
ReferenceUllah,Phytochem.,51,(1999),99