input word = C00022525

Metabolite InformationStructural formula
Name Viscidic acid B
ent-15-Acetoxy-8(17),13E-labdadien-18-oic acid
Formula C22H34O4
Mw 362.24570957
CAS RN 77096-81-2
C_ID C00022525 ,
InChIKey HSANNLXBHKRHSH-KZDPVMGTNA-N
InChICode InChI=1S/C22H34O4/c1-15(11-14-26-17(3)23)7-9-18-16(2)8-10-19-21(18,4)12-6-13-22(19,5)20(24)25/h11,18-19H,2,6-10,12-14H2,1,3-5H3,(H,24,25)/b15-11+/t18-,19+,21-,22+/m1/s1
SMILES C1C[C@@]([C@@H]2[C@](C1)([C@@H](C(=C)CC2)CC/C(=C/COC(=O)C)/C)C)(C(=O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeChrysothamnus viscidiflorus Ref.
zoom in