input word = C00023293

Metabolite InformationStructural formula
Name ent-8alphaH,13Z-Labdene-15,17-dioic acid
Formula C20H32O4
Mw 336.23005951
CAS RN 74513-89-6
C_ID C00023293 ,
InChIKey FHJAUHMFXISXSW-XKLKVYOBNA-N
InChICode InChI=1S/C20H32O4/c1-13(12-17(21)22)6-8-15-14(18(23)24)7-9-16-19(2,3)10-5-11-20(15,16)4/h12,14-16H,5-11H2,1-4H3,(H,21,22)(H,23,24)/b13-12-/t14-,15-,16-,20+/m1/s1
SMILES C/C(=C/C(=O)O)CC[C@@H]1[C@H](C(=O)O)CC[C@@H]2C(C)(C)CCC[C@@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAyapana amygdalina Ref.
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OrganismAyapana amygdalina
ReferenceBohlmann,Phytochem.,18,(1979),1997