Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
Click a node to open it in a new tab
Herb: 2Ingredient: 1Target: 7Links: 9
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 64944
- Core Entity Id
- 111962
- Source Entity Count
- 1
- Preferred Name
- Xanthurenic Acid
- Name En
- Pubchem Id
- 5699
- Smiles Canonical
- C1=CC2=C(C(=C1)O)NC(=CC2=O)C(=O)O
- Molecular Formula
- C10H7NO4
- Molecular Weight
- 205.1700
- Inchikey
- FBZONXHGGPHHIY-UHFFFAOYSA-N
- Inchi
- InChI=1S/C10H7NO4/c12-7-3-1-2-5-8(13)4-6(10(14)15)11-9(5)7/h1-4,12H,(H,11,13)(H,14,15)
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 0.9000
- Num H Donors
- 3
- Num H Acceptors
- 5
- Num Rotatable Bonds
- 1
- Drug Likeness
- Polar Surface Area
- 86.6000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Xanthurenic Acid
Role
preferred
Source
SymMap_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Sym Map
SMIT27477
Attributes
Merged source attributes and domain-specific metadata.
Type
Blood ingredients,Metabolic ingredients
Version
v2
Suppress
0
Molecule Formula
C10H7NO4