input word = C00011786

Metabolite InformationStructural formula
Name Ursiniolide B
Formula C24H32O9
Mw 464.20463262
CAS RN 58857-01-5
C_ID C00011786 ,
InChIKey MDEMWAXREYWVBU-SWVSOIPVNA-N
InChICode InChI=1S/C24H32O9/c1-12-8-9-18(31-17(6)26)13(2)11-20-21(14(3)22(27)32-20)19(10-12)33-23(28)24(7,29)15(4)30-16(5)25/h8,11,15,18-21,29H,3,9-10H2,1-2,4-7H3/b12-8-,13-11+/t15-,18-,19+,20-,21+,24+/m1/s1
SMILES C=C1C(=O)OC2/C=C(C)C(OC(C)=O)C/C=C(/C)CC(OC(=O)C(C)(O)C(C)OC(C)=O)C12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeUrsinia anthemoides Ref.
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