input word = C00045452

Metabolite InformationStructural formula
Name Xanthanthusin H
(-)-Xanthanthusin H
Formula C24H28O8
Mw 444.17841787
CAS RN 436142-41-5
C_ID C00045452 ,
InChIKey UUVKKHSAZOSIOH-GWYYVJSXNA-N
InChICode InChI=1S/C24H28O8/c1-11(10-31-12(2)25)14-17(27)15-16(19(29)21(14)32-13(3)26)24(6)9-7-8-23(4,5)22(24)20(30)18(15)28/h11,30H,7-10H2,1-6H3/t11-,24-/m1/s1
SMILES CC(=O)OCC(C)C1=C(OC(C)=O)C(=O)C2=C(C(=O)C(O)=C3C(C)(C)CCC[C@]23C)C1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLamiaceaeColeus xanthanthus Ref.
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