input word = C00054337

Metabolite InformationStructural formula
Name 3alpha-Acetoxy-11-keto-beta-boswellic acid
Formula C32H48O5
Mw 512.35017464
CAS RN 67416-61-9
C_ID C00054337
InChIKey HMMGKOVEOFBCAU-BCDBGHSCSA-N
InChICode InChI=1S/C32H48O5/c1-18-9-12-28(4)15-16-30(6)21(25(28)19(18)2)17-22(34)26-29(5)13-11-24(37-20(3)33)32(8,27(35)36)23(29)10-14-31(26,30)7/h17-19,23-26H,9-16H2,1-8H3,(H,35,36)/t18-,19+,23-,24-,25+,26-,28-,29+,30-,31-,32-/m1/s1
SMILES C[C@](C1=C2)(CC[C@]3(C)[C@@]1([H])[C@@H](C)[C@H](C)CC3)[C@]4(C)CC[C@@]5([H])[C@](C(O)=O)(C)[C@H](OC(C)=O)CC[C@]5(C)[C@@]4([H])C2=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBurseraceaeBoswellia serrata Ref.
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