4-demethyl-7-deoxydoxorubicinolone
- Other Name: (9R)-9-(1,2-dihydroxyethyl)-4,6,9,11-tetrahydroxy-8,10-dihydro-7H-tetracene-5,12-dione
- InChIKey: CFDPRVCIBVUZSE-VLFLDKFOSA-N
- InChI: InChI=1S/C20H18O8/c21-7-12(23)20(28)5-4-8-10(6-20)18(26)14-15(16(8)24)19(27)13-9(17(14)25)2-1-3-11(13)22/h1-3,12,21-24,26,28H,4-7H2/t12?,20-/m1/s1
- SMILES: C1C[C@@](CC2=C1C(=C3C(=C2O)C(=O)C4=C(C3=O)C(=CC=C4)O)O)(C(CO)O)O
- Exact Mass: 386.10017
- Molecular Formula: C20H18O8
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Compound CID:
122197270
122197270
Hidden Reactions Filter
Some biological reactions link very small precursors (e.g. CO₂, acetate) to much larger products.
These reactions are correct, but they can create unrealistic shortest paths and connect otherwise separate parts of the graph.
To keep the overview readable, FAIR-TPs hides six such reactions where a <60 Da precursor leads to a >300 Da product in the visualisations.
You can have all these paths in the download output.
You can have all these paths in the download output.
Hidden reaction pairs (precursor → product):
- Acetate → N-(2-benzoyl-4-chlorophenyl)-2-acetamidoacetamide
- Acetate → N-(2-benzoyl-4-chlorophenyl)-2-acetamido-n-methylacetamide
- Carbon dioxide → Formylmethanofuran
- Acrolein → Chembl3706542
- Ethylene oxide → Acetyl-coa
- Formaldehyde → S-hydroxymethylglutathione
Note: In the graph output, up to 100 compounds are displayed for faster visualization. For the full output, please use the export files.
Click on a node or edge to see details here.