Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Target: 1Links: 3
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 67503
- Core Entity Id
- 130152
- Source Entity Count
- 1
- Preferred Name
- 2-hydroxyl-5-methoxybenzoic acid
- Name En
- Pubchem Id
- 75787
- Smiles Canonical
- COC1=CC(=C(C=C1)O)C(=O)O
- Molecular Formula
- C8H8O4
- Molecular Weight
- 168.0400
- Inchikey
- IZZIWIAOVZOBLF-UHFFFAOYSA-N
- Inchi
- InChI=1S/C8H8O4/c1-12-5-2-3-7(9)6(4-5)8(10)11/h2-4,9H,1H3,(H,10,11)
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 2.5000
- Num H Donors
- 2
- Num H Acceptors
- 4
- Num Rotatable Bonds
- 2
- Drug Likeness
- Polar Surface Area
- 66.8000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
2-hydroxyl-5-methoxybenzoic acid
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
2-hydroxyl-5-methoxybenzoic acid
Itcmdb Generated
ITX-INGREDIENT-D78692970E44
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
168.040
Molecular Formula
C8H8O4
Fda Maximum Daily Dose (Fdamdd)
0.010
Quantitative Estimate Of Drug Likeness（Qed）
0.693