input word = C00049068

Metabolite InformationStructural formula
Name 13,28-Epoxy-11-oleanene-3-one
(+)-13,28-Epoxy-11-oleanene-3-one
Formula C30H46O2
Mw 438.34978071
CAS RN 207970-59-0
C_ID C00049068 ,
InChIKey BFSRJRKZZSIEFP-JCXCDMDINA-N
InChICode InChI=1S/C30H46O2/c1-24(2)14-16-29-17-15-28(7)27(6)12-8-20-25(3,4)23(31)10-11-26(20,5)21(27)9-13-30(28,32-19-29)22(29)18-24/h9,13,20-22H,8,10-12,14-19H2,1-7H3/t20-,21-,22-,26+,27-,28+,29?,30-/m1/s1
SMILES C1[C@@H]2[C@]3(CCC1(C)C)CC[C@@]1([C@]2(C=C[C@H]2[C@]1(CC[C@H]1[C@@]2(CCC(=O)C1(C)C)C)C)OC3)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAdoxaceaeViburnum awabuki Ref.
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