input word = C00047128

Metabolite InformationStructural formula
Name Xerophilusin C
Formula C20H28O6
Mw 364.18858863
CAS RN 272459-38-8
C_ID C00047128 ,
InChIKey CAWHJWGTBIGGQR-MUQXDNMJNA-N
InChICode InChI=1S/C20H28O6/c1-8-9-4-5-10-18-11(21)6-7-17(2,3)12(18)14(23)20(24)19(10,13(8)22)15(9)25-16(18)26-20/h8-12,14-16,21,23-24H,4-7H2,1-3H3/t8-,9-,10-,11-,12+,14-,15-,16-,18-,19-,20+/m0/s1
SMILES C[C@@H]1C(=O)[C@@]23[C@H]4O[C@H]5O[C@]2(O)[C@@H](O)[C@@H]2C(C)(C)CC[C@H](O)C52[C@@H]3CC[C@@H]14
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon xerophilus Ref.
zoom in