input word = C00038271

Metabolite InformationStructural formula
Name 3-Oxo-11,13(18)-oleandien-28-oic acid
(-)-3-Oxo-11,13(18)-oleandien-28-oic acid
Formula C30H44O3
Mw 452.32904527
CAS RN 272107-98-9
C_ID C00038271 ,
InChIKey QLTFHGMEDZMMTF-XOHVAQTANA-N
InChICode InChI=1S/C30H44O3/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7/h8-9,21-22H,10-18H2,1-7H3,(H,32,33)/t21-,22+,27-,28+,29+,30-/m0/s1
SMILES C1C(=O)C([C@H]2[C@](C1)([C@@H]1[C@@](CC2)([C@]2(C(=C3[C@@](CC2)(CCC(C3)(C)C)C(=O)O)C=C1)C)C)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeEkebergia capensis Ref.
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