input word = C00007967

Metabolite InformationStructural formula
Name Calomelanol D-1
Formula C24H20O5
Mw 388.13107375
CAS RN 73810-61-4
C_ID C00007967 ,
InChIKey AFAVBHVAMSRTSZ-UHFFFAOYNA-N
InChICode InChI=1S/C24H20O5/c25-18(12-11-15-7-3-1-4-8-15)23-20(27)14-19(26)22-17(13-21(28)29-24(22)23)16-9-5-2-6-10-16/h1-10,14,17,26-27H,11-13H2/t17-/m0/s1
SMILES c1(cc(c(c2c1[C@H](c1ccccc1)CC(=O)O2)C(=O)CCc1ccccc1)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePteridaceaePityrogramma calomelanos Ref.
PlantaePteridaceaePityrogramma tartarea Ref.
zoom in