input word = C00022192

Metabolite InformationStructural formula
Name Apo-12'-capsorubinal
Formula C25H34O3
Mw 382.25079495
CAS RN 336105-82-9
C_ID C00022192 ,
InChIKey MWEPRWWNHJVNMU-YGWWIANTNA-N
InChICode InChI=1S/C25H34O3/c1-19(10-7-8-11-21(3)18-26)12-9-13-20(2)14-15-23(28)25(6)17-22(27)16-24(25,4)5/h7-15,18,22,27H,16-17H2,1-6H3/b8-7+,12-9+,15-14+,19-10+,20-13+,21-11+/t22-,25-/m0/s1
SMILES [C@@H]1(CC([C@@](C1)(C(=O)/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=O)\C)/C)/C)C)(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeCapsicum annuum Ref.
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