Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 5Ingredient: 1Target: 12Links: 17
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 64752
- Core Entity Id
- 111770
- Source Entity Count
- 1
- Preferred Name
- Sphinganine
- Name En
- Pubchem Id
- 91486
- Smiles Canonical
- CCCCCCCCCCCCCCCC(C(CO)N)O
- Molecular Formula
- C18H39NO2
- Molecular Weight
- 301.5000
- Inchikey
- OTKJDMGTUTTYMP-ZWKOTPCHSA-N
- Inchi
- InChI=1S/C18H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h17-18,20-21H,2-16,19H2,1H3/t17-,18+/m0/s1
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 5.8000
- Num H Donors
- 3
- Num H Acceptors
- 3
- Num Rotatable Bonds
- 16
- Drug Likeness
- Polar Surface Area
- 66.5000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Sphinganine
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
Sphinganine
Role
preferred
Source
SymMap_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Sym Map
SMIT26895
Itcmdb Generated
ITX-INGREDIENT-32A1BDF6CBA0
Attributes
Merged source attributes and domain-specific metadata.
Type
Metabolic ingredients
Version
v2
Suppress
0