input word = C00035396

Metabolite InformationStructural formula
Name Tagalsin A
Formula C20H28O3
Mw 316.20384476
CAS RN 862588-79-2
C_ID C00035396 ,
InChIKey XJFGTYYCVFPPMQ-UBUAIZCSNA-N
InChICode InChI=1S/C20H28O3/c1-5-17(2)8-9-18(3)13(11-17)6-7-19(4)15(18)10-14(21)16(22)20(19)12-23-20/h5,10,13,15,21H,1,6-9,11-12H2,2-4H3/t13-,15+,17-,18-,19-,20-/m0/s1
SMILES C1[C@@](C[C@H]2[C@](C1)([C@@H]1[C@](CC2)([C@]2(C(=O)C(=C1)O)OC2)C)C)(C=C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRhizophoraceaeCeriops tagal Ref.
zoom in



OrganismCeriops tagal
ReferenceZhang,Phytochem.,66,(2005),1465