input word = C00060500

Metabolite InformationStructural formula
Name Dicyclocohumulinol A
Formula C20H28O7
Mw 380.18350325
CAS RN 1821029-99-5
C_ID C00060500
InChIKey KPWPITQSRWPTMA-VIGKQPONSA-N
InChICode InChI=1S/C20H28O7/c1-9(2)7-11-12(18(5,6)25)8-19(26)16(23)13(14(21)10(3)4)17(24)20(19,27)15(11)22/h7,10-12,24-27H,8H2,1-6H3/t11?,12?,19-,20+/m0/s1
SMILES CC(C)=CC1C(=O)C2(O)C(O)=C(C(=O)C(C)C)C(=O)C2(O)CC1C(C)(C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCannabaceaeHumulus lupulus Ref.
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