Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 4Ingredient: 1Links: 4
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 64525
- Core Entity Id
- 111543
- Source Entity Count
- 1
- Preferred Name
- Phenylacetylglycine
- Name En
- Pubchem Id
- 68144
- Smiles Canonical
- C1=CC=C(C=C1)CC(=O)NCC(=O)O
- Molecular Formula
- C10H11NO3
- Molecular Weight
- 193.2000
- Inchikey
- UTYVDVLMYQPLQB-UHFFFAOYSA-N
- Inchi
- InChI=1S/C10H11NO3/c12-9(11-7-10(13)14)6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,12)(H,13,14)
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 0.7000
- Num H Donors
- 2
- Num H Acceptors
- 3
- Num Rotatable Bonds
- 4
- Drug Likeness
- Polar Surface Area
- 66.4000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Phenylacetylglycine
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
Phenylacetylglycine
Role
preferred
Source
SymMap_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Sym Map
SMIT26089
Pub Chem
68144
Itcmdb Generated
ITX-INGREDIENT-926C1DE64475
Attributes
Merged source attributes and domain-specific metadata.
Type
Blood ingredients,Metabolic ingredients
Version
v2
Suppress
0
Molecule Formula
C10H11NO3