input word = C00032536

Metabolite InformationStructural formula
Name Xysmalogenin
5,6-Dehydrouzarigenin
Formula C23H32O4
Mw 372.23005951
CAS RN 508-92-9
C_ID C00032536 ,
InChIKey ZICGJBPBLVXOBM-ZNMIDSEQNA-N
InChICode InChI=1S/C23H32O4/c1-21-8-5-16(24)12-15(21)3-4-19-18(21)6-9-22(2)17(7-10-23(19,22)26)14-11-20(25)27-13-14/h3,11,16-19,24,26H,4-10,12-13H2,1-2H3/t16-,17+,18-,19+,21-,22+,23-/m0/s1
SMILES C1[C@@H](CC2=CC[C@@H]3[C@@H]([C@]2(C1)C)CC[C@]1([C@@]3(CC[C@@H]1C1=CC(=O)OC1)O)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeAsclepias curassavica L. Ref.
PlantaeApocynaceaePeriploca sepium Ref.
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