input word = C00038993

Metabolite InformationStructural formula
Name Deserticolic acid
(-)-Deserticolic acid
Formula C20H32O3
Mw 320.23514489
CAS RN 260389-47-7
C_ID C00038993 ,
InChIKey PVBKHWHXNRGSBL-IQHSHDIENA-N
InChICode InChI=1S/C20H32O3/c1-14(12-18(22)23)8-10-19(4)15(2)9-11-20(13-21)16(3)6-5-7-17(19)20/h6,12,15,17,21H,5,7-11,13H2,1-4H3,(H,22,23)/b14-12+/t15-,17-,19+,20+/m1/s1
SMILES CC1=CCC[C@H]2[C@]1(CO)CC[C@@H](C)[C@]2(C)CC/C(C)=C/C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHaplopappus deserticola Ref.
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