input word = C00055116

Metabolite InformationStructural formula
Name Yucalexin B18
Formula C20H30O3
Mw 318.21949482
CAS RN 119626-53-8
C_ID C00055116
InChIKey RFHATUKAQMWSEN-OCDWHGDGSA-N
InChICode InChI=1S/C20H30O3/c1-17(2)13-5-6-20-8-7-18(3,11-20)15(22)9-14(20)19(13,4)10-12(21)16(17)23/h7-8,13-16,22-23H,5-6,9-11H2,1-4H3/t13-,14+,15+,16-,18-,19-,20+/m1/s1
SMILES O[C@@H](C(C)(C)[C@](CC[C@@]12[C@@]3([H])C[C@H](O)[C@](C)(C=C2)C1)([H])[C@@]3(C)C4)C4=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeManihot esculent Ref.
PlantaeEuphorbiaceaeManihot esculenta Ref.
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OrganismManihot esculenta
ReferencePiacenza, L.P.L. et al., JCS Perkin 1, 1979, 1004-1012 (Androstachys johnsonii constit)