input word = C00008112

Metabolite InformationStructural formula
Name Adunctin B
Formula C26H30O4
Mw 406.21440945
CAS RN 151484-74-1
C_ID C00008112 ,
InChIKey HQPBWCKPGXUXIH-JMFPVCQJNA-N
InChICode InChI=1S/C26H30O4/c1-16(2)18-12-13-26(3)19(14-18)23-22(29-4)15-21(28)24(25(23)30-26)20(27)11-10-17-8-6-5-7-9-17/h5-9,12-13,15-16,18-19,28H,10-11,14H2,1-4H3/t18-,19-,26+/m0/s1
SMILES c1c(c(c2c(c1OC)[C@H]1[C@](O2)(C=C[C@@H](C1)C(C)C)C)C(=O)CCc1ccccc1)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePiperaceaePiper aduncum Ref.
zoom in