input word = C00023455

Metabolite InformationStructural formula
Name Abeoanticopalic acid
Formula C20H30O2
Mw 302.2245802
CAS RN 109291-59-0
C_ID C00023455 ,
InChIKey AYZMGUHJPVGYEB-QQFSOEFFNA-N
InChICode InChI=1S/C20H30O2/c1-13(12-19(21)22)6-8-17-15(3)7-9-18-16(4)14(2)10-11-20(17,18)5/h12,14,17-18H,3-4,6-11H2,1-2,5H3,(H,21,22)/b13-12+/t14-,17+,18+,20-/m1/s1
SMILES C1[C@H](C(=C)[C@H]2[C@](C1)([C@H](C(=C)CC2)CC/C(=C/C(=O)O)/C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePinaceaePinus strobus Ref.
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