input word = C00051501

Metabolite InformationStructural formula
Name Masticadienonic acid
Formula C30H46O3
Mw 454.34469533
CAS RN 514-49-8
C_ID C00051501
InChIKey XXBQFIJFFSTMNY-TUMOLJAANA-N
InChICode InChI=1S/C30H46O3/c1-19(9-8-10-20(2)26(32)33)21-13-17-30(7)23-11-12-24-27(3,4)25(31)15-16-28(24,5)22(23)14-18-29(21,30)6/h10-11,19,21-22,24H,8-9,12-18H2,1-7H3,(H,32,33)/b20-10-/t19-,21-,22-,24-,28+,29-,30+/m0/s1
SMILES C/C(=C/CC[C@H](C)[C@@H]1CC[C@]2(C)C3=CC[C@H]4C(C)(C)C(=O)CC[C@]4(C)[C@H]3CC[C@@]12C)OC=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnacardiaceaePistacia spp. Ref.
PlantaeAnacardiaceaePistacia terebinthus Ref.
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