input word = C00060497

Metabolite InformationStructural formula
Name Scorpiohumulinol A
Formula C21H30O7
Mw 394.19915331
CAS RN 1821029-96-2
C_ID C00060497
InChIKey IDRIZLVBKIJLFP-RZOVJBFXSA-N
InChICode InChI=1S/C21H30O7/c1-10(2)7-12(22)15-16(23)19(25)9-13-18(5,6)28-14(8-11(3)4)20(13,26)21(19,27)17(15)24/h8,10,13-14,24-27H,7,9H2,1-6H3/t13-,14+,19-,20+,21+/m0/s1
SMILES CC(C)=CC1OC(C)(C)C2CC3(O)C(=O)C(C(=O)CC(C)C)=C(O)C3(O)C12O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCannabaceaeHumulus lupulus Ref.
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