Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Target: 2Links: 5
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 66734
- Core Entity Id
- 129383
- Source Entity Count
- 1
- Preferred Name
- 1-methyloctadecylamine
- Name En
- Pubchem Id
- 141647
- Smiles Canonical
- CCCCCCCCCCCCCCCCCC(C)N
- Molecular Formula
- C19H41N
- Molecular Weight
- 283.3200
- Inchikey
- CRTBHHWJNLQHEB-UHFFFAOYSA-N
- Inchi
- InChI=1S/C19H41N/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(2)20/h19H,3-18,20H2,1-2H3
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 8.6000
- Num H Donors
- 1
- Num H Acceptors
- 1
- Num Rotatable Bonds
- 16
- Drug Likeness
- Polar Surface Area
- 26.0000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
1-methyloctadecylamine
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
1-methyloctadecylamine
Itcmdb Generated
ITX-INGREDIENT-B8CCE7379144
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
283.320
Molecular Formula
C19H41N
Fda Maximum Daily Dose (Fdamdd)
0.053
Quantitative Estimate Of Drug Likeness（Qed）
0.317