input word = C00031658

Metabolite InformationStructural formula
Name Cassigarol G
Formula C28H20O8
Mw 484.11581762
CAS RN 158732-57-1
C_ID C00031658 ,
InChIKey DWARHOLOHNYUGA-SSFBFVQWNA-N
InChICode InChI=1S/C28H20O8/c29-15-5-14(6-16(30)8-15)2-1-13-3-4-24-25(7-13)36-27-19-12-22(33)21(32)11-18(19)26-20(28(27)35-24)9-17(31)10-23(26)34/h1-12,27-34H/b2-1+/t27-,28-/m1/s1
SMILES c1(ccc2c(c1)O[C@H]1[C@H](O2)c2cc(cc(c2c2c1cc(c(c2)O)O)O)O)/C=C/c1cc(cc(c1)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeCaragana tibetica KOM. Ref.
zoom in