input word = C00035978

Metabolite InformationStructural formula
Name 7-Oxodehydroabietic acid
7-Ketodehydroabietic acid
Formula C20H26O3
Mw 314.1881947
CAS RN 18684-55-4
C_ID C00035978 ,
InChIKey MSWJSDLNPCSSNW-NQDYJFDNNA-N
InChICode InChI=1S/C20H26O3/c1-12(2)13-6-7-15-14(10-13)16(21)11-17-19(15,3)8-5-9-20(17,4)18(22)23/h6-7,10,12,17H,5,8-9,11H2,1-4H3,(H,22,23)/t17-,19-,20-/m1/s1
SMILES C1C[C@@]([C@H]2[C@](C1)(c1c(C(=O)C2)cc(cc1)C(C)C)C)(C)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePinaceaePicea morrisonicola Ref.
--picea morrisonicola Ref.
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