input word = C00040743

Metabolite InformationStructural formula
Name (+)-(4->2)-abeo-Kolavelool-3-oic acid
Formula C20H32O3
Mw 320.23514489
CAS RN 221465-54-9
C_ID C00040743 ,
InChIKey SOBYMLTWZSESRW-WKBHJIJCNA-N
InChICode InChI=1S/C20H32O3/c1-7-18(4,23)10-11-19(5)13(2)8-9-20(6)14(3)15(17(21)22)12-16(19)20/h7,13,16,23H,1,8-12H2,2-6H3,(H,21,22)/t13-,16-,18+,19+,20+/m1/s1
SMILES C=C[C@](C)(O)CC[C@@]1(C)[C@H](C)CC[C@@]2(C)C(C)=C(C(=O)O)C[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAristolochiaceaeAristolochia chamissonis Duch. Ref.
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