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: 1Links: 3
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 64422
- Core Entity Id
- 111440
- Source Entity Count
- 1
- Preferred Name
- Octadecanamide
- Name En
- Pubchem Id
- 31292
- Smiles Canonical
- CCCCCCCCCCCCCCCCCC(=O)N
- Molecular Formula
- C18H37NO
- Molecular Weight
- 283.2900
- Inchikey
- LYRFLYHAGKPMFH-UHFFFAOYSA-N
- Inchi
- InChI=1S/C18H37NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-17H2,1H3,(H2,19,20)
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 6.8000
- Num H Donors
- 1
- Num H Acceptors
- 1
- Num Rotatable Bonds
- 16
- Drug Likeness
- Polar Surface Area
- 43.1000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Octadecanamide
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
octadecanamide
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Sym Map
SMIT25784
Etcm Ingredient
octadecanamide
Itcmdb Generated
ITX-INGREDIENT-02A958F04235ITX-INGREDIENT-502E93DD6E0F
Attributes
Merged source attributes and domain-specific metadata.
Type
Metabolic ingredients
Version
v2
Suppress
0
Molecular Weight
283.290
Molecular Formula
C18H37NO
Fda Maximum Daily Dose (Fdamdd)
0.011
Quantitative Estimate Of Drug Likeness（Qed）
0.361