input word = C00022407

Metabolite InformationStructural formula
Name 13S-Hydroxy-7,14-labdadien-19-oic acid
Formula C20H32O3
Mw 320.23514489
CAS RN 39702-13-1
C_ID C00022407 ,
InChIKey OZZHGCYPWHSLKA-IDWAWCNHNA-N
InChICode InChI=1S/C20H32O3/c1-6-18(3,23)13-10-15-14(2)8-9-16-19(15,4)11-7-12-20(16,5)17(21)22/h6,8,15-16,23H,1,7,9-13H2,2-5H3,(H,21,22)/t15-,16-,18+,19+,20-/m0/s1
SMILES C1C[C@@]([C@@H]2[C@](C1)([C@H](C(=CC2)C)CC[C@](O)(C=C)C)C)(C(=O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraucariaceaeAgathis robusta Ref.
zoom in