input word = C00042455

Metabolite InformationStructural formula
Name Dehydroabietic acid
Formula C20H28O2
Mw 300.20893014
CAS RN 1740-19-8
C_ID C00042455 ,
InChIKey NFWKVWVWBFBAOV-NQDYJFDNNA-N
InChICode InChI=1S/C20H28O2/c1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22/h6,8,12-13,17H,5,7,9-11H2,1-4H3,(H,21,22)/t17-,19-,20-/m1/s1
SMILES c1c2c(cc(c1)C(C)C)CC[C@@H]1[C@@]2(CCC[C@@]1(C)C(=O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBurseraceaeCommiphora myrrha Ref.
PlantaeCelastraceaeTripterygium wilfordii Ref.
PlantaeLamiaceaeRabdosia nervosa Ref.
PlantaePinaceaePicea abies Ref.
PlantaePinaceaePicea ajanensis Ref.
PlantaePinaceaePicea glehni Ref.
PlantaePinaceaePicea glehnii L. Ref.
PlantaePinaceaePicea koraiensis Ref.
PlantaePinaceaePinus luchuensis Ref.
PlantaePinaceaePinus sibirica Ref.
PlantaePinaceaePinus taeda Ref.
PlantaePinaceaePseudotsuga wilsoniana Ref.
--Sitka spruce Ref.
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