input word = C00007969

Metabolite InformationStructural formula
Name Calomelanol B
Formula C24H20O6
Mw 404.12598837
CAS RN 137319-45-0
C_ID C00007969 ,
InChIKey HGMBLMAQBAQIBW-UHFFFAOYNA-N
InChICode InChI=1S/C24H20O6/c25-16-9-6-14(7-10-16)8-11-18(26)23-20(28)13-19(27)22-17(12-21(29)30-24(22)23)15-4-2-1-3-5-15/h1-7,9-10,13,17,25,27-28H,8,11-12H2/t17-/m1/s1
SMILES c1(cc(c(c2c1[C@@H](c1ccccc1)CC(=O)O2)C(=O)CCc1ccc(cc1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePteridaceaePityrogramma calomelanos Ref.
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