input word = C00021422

Metabolite InformationStructural formula
Name 14-Hydroxyvaginatin
Formula C20H30O5
Mw 350.20932407
CAS RN 128397-55-7
C_ID C00021422 ,
InChIKey UXXJAHJNHYCPJW-PFNLKJAINA-N
InChICode InChI=1S/C20H30O5/c1-6-13(4)18(23)25-17-9-14(11-21)7-8-20(24)15(12(2)3)10-16(22)19(17,20)5/h6,9,12,15,17,21,24H,7-8,10-11H2,1-5H3/b13-6+/t15-,17+,19+,20+/m0/s1
SMILES [C@@]12([C@@](CCC(=C[C@H]1OC(=O)/C(=C/C)/C)CO)([C@@H](CC2=O)C(C)C)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeFerula sinaica Ref.
zoom in