phenolphthalein-diglucuronide
- Other Name: Phenolphthalein-diglucuronide
- InChIKey: KSSXNJXUWUGBFP-UHFFFAOYSA-N
- InChI: InChI=1S/C32H30O16/c33-19-21(35)25(27(39)40)46-30(23(19)37)44-15-9-5-13(6-10-15)32(18-4-2-1-3-17(18)29(43)48-32)14-7-11-16(12-8-14)45-31-24(38)20(34)22(36)26(47-31)28(41)42/h1-12,19-26,30-31,33-38H,(H,39,40)(H,41,42)
- SMILES: C1=CC=C2C(=C1)C(=O)OC2(C3=CC=C(C=C3)OC4C(C(C(C(O4)C(=O)O)O)O)O)C5=CC=C(C=C5)OC6C(C(C(C(O6)C(=O)O)O)O)O
- Exact Mass: 670.15338
- Molecular Formula: C32H30O16
-
Compound CID:
78122568
78122568
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.