input word = C00024086

Metabolite InformationStructural formula
Name 15alpha,22beta-Dihydroxytingenone
Formula C28H36O5
Mw 452.25627426
CAS RN 130838-59-4
C_ID C00024086 ,
InChIKey ZUBJJQDAWBBCMZ-UHFFFAOYNA-N
InChICode InChI=1S/C28H36O5/c1-14-11-20-26(4,24(33)22(14)31)13-21(30)28(6)19-8-7-16-15(2)23(32)18(29)12-17(16)25(19,3)9-10-27(20,28)5/h7-8,12,14,20-21,24,30,32-33H,9-11,13H2,1-6H3/t14-,20-,21+,24+,25-,26-,27+,28-/m0/s1
SMILES CC1=C(O)C(=O)C=C2C1=CC=C1C2(C)CCC2(C)C3CC(C)C(=O)C(O)C3(C)CC(O)C12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeElaeodendron balae KOSTERM. Ref.
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