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
- 62874
- Core Entity Id
- 109892
- Source Entity Count
- 1
- Preferred Name
- 4-Amino-Butyraldehyde
- Name En
- Pubchem Id
- 118
- Smiles Canonical
- C(CC=O)CN
- Molecular Formula
- C4H9NO
- Molecular Weight
- 87.1200
- Inchikey
- DZQLQEYLEYWJIB-UHFFFAOYSA-N
- Inchi
- InChI=1S/C4H9NO/c5-3-1-2-4-6/h4H,1-3,5H2
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- -0.9000
- Num H Donors
- 1
- Num H Acceptors
- 2
- Num Rotatable Bonds
- 3
- Drug Likeness
- Polar Surface Area
- 43.1000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
4-Amino-Butyraldehyde
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
4-Amino-Butyraldehyde
Role
preferred
Source
SymMap_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Sym Map
SMIT21474
Itcmdb Generated
ITX-INGREDIENT-CA0EAF1CAE35
Attributes
Merged source attributes and domain-specific metadata.
Type
Metabolic ingredients
Version
v2
Suppress
0