input word = C00063341

Metabolite InformationStructural formula
Name (4alpha,6beta,7beta,12beta)-6,7,12-Trihydroxy-kaur-16-en-18-oic acid
Formula C20H30O5
Mw 350.20932407
CAS RN 90806-33-0
C_ID C00063341
InChIKey GDUDOACZUAVXMK-QHKVRRPYSA-N
InChICode InChI=1S/C20H30O5/c1-10-8-20-9-11(10)12(21)7-13(20)18(2)5-4-6-19(3,17(24)25)15(18)14(22)16(20)23/h11-16,21-23H,1,4-9H2,2-3H3,(H,24,25)/t11-,12+,13-,14-,15-,16-,18-,19+,20-/m0/s1
SMILES C=C1CC23CC1C(O)CC2C1(C)CCCC(C)(C(=O)O)C1C(O)C3O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCucurbitaceaeCucurbita sp. Ref.
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