input word = C00044581

Metabolite InformationStructural formula
Name Briarellin K
(-)-Briarellin K
Formula C22H32O6
Mw 392.21988875
CAS RN 503552-40-7
C_ID C00044581 ,
InChIKey QODOELUKAUITNQ-IGQBLQOINA-N
InChICode InChI=1S/C22H32O6/c1-11-10-16-18-17-14(6-8-21(18,4)27-13(3)23)12(2)20(25)28-22(5,19(17)26-16)9-7-15(11)24/h12,14-19,24H,1,6-10H2,2-5H3/t12-,14+,15-,16+,17+,18+,19+,21-,22+/m1/s1
SMILES C=C1C[C@@H]2O[C@H]3[C@@H]4[C@H]2[C@](C)(OC(C)=O)CC[C@H]4C(C)C(=O)O[C@@]3(C)CC[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Briareum polyanthes Ref.
zoom in