Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Links: 1
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 66895
- Core Entity Id
- 129544
- Source Entity Count
- 1
- Preferred Name
- 2,2'
- Name En
- Pubchem Id
- Smiles Canonical
- Molecular Formula
- C12H8S3
- Molecular Weight
- 247.9800
- Inchikey
- Inchi
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- Num H Donors
- Num H Acceptors
- Num Rotatable Bonds
- Drug Likeness
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
2,2'
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
5',2''-Trithiophene
Role
preferred
Source
ETCM_v2
Preferred
Yes
Aliases
Additional names normalized into the restored final schema.
5',2''-Trithiophene
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
2,2'
Itcmdb Generated
ITX-INGREDIENT-32B35401F48B
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
247.980
Molecular Formula
C12H8S3
Fda Maximum Daily Dose (Fdamdd)
0.049
Quantitative Estimate Of Drug Likeness（Qed）
0.584