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
- 63052
- Core Entity Id
- 110070
- Source Entity Count
- 1
- Preferred Name
- 9-Decenoylcarnitine
- Name En
- Pubchem Id
- 53481651
- Smiles Canonical
- C[N+](C)(C)CC(CC(=O)[O-])OC(=O)CCCCCCCC=C
- Molecular Formula
- C17H31NO4
- Molecular Weight
- 313.4000
- Inchikey
- GOOOCIIXFLVRAG-UHFFFAOYSA-N
- Inchi
- InChI=1S/C17H31NO4/c1-5-6-7-8-9-10-11-12-17(21)22-15(13-16(19)20)14-18(2,3)4/h5,15H,1,6-14H2,2-4H3
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 3.9000
- Num H Donors
- 0
- Num H Acceptors
- 4
- Num Rotatable Bonds
- 13
- Drug Likeness
- Polar Surface Area
- 66.4000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
9-Decenoylcarnitine
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
9-Decenoylcarnitine
Role
preferred
Source
SymMap_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Sym Map
SMIT22097
Itcmdb Generated
ITX-INGREDIENT-457F95D40D8F
Attributes
Merged source attributes and domain-specific metadata.
Type
Metabolic ingredients
Version
v2
Suppress
0