input word = C00023380

Metabolite InformationStructural formula
Name ent-6beta,17-Diacetoxy-14,15-dinor-7,11E-labdadien-13-one
Formula C22H32O5
Mw 376.22497413
CAS RN 110201-89-3
C_ID C00023380 ,
InChIKey VWSIRBHDCATCTC-VRUJPUKNNA-N
InChICode InChI=1S/C22H32O5/c1-14(23)8-9-18-17(13-26-15(2)24)12-19(27-16(3)25)20-21(4,5)10-7-11-22(18,20)6/h8-9,12,18-20H,7,10-11,13H2,1-6H3/b9-8+/t18-,19-,20-,22+/m1/s1
SMILES CC(=O)/C=C/[C@@H]1C(COC(C)=O)=C[C@H](OC(C)=O)[C@@H]2C(C)(C)CCC[C@@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeRutidosis murchisonii Ref.
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OrganismRutidosis murchisonii
ReferenceZdero,Phytochem.,26,(1987),1759