Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 3Ingredient: 1Target: 12Links: 15
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 64758
- Core Entity Id
- 111776
- Source Entity Count
- 1
- Preferred Name
- Sphingosine 1-Phosphate
- Name En
- Pubchem Id
- 5283560
- Smiles Canonical
- CCCCCCCCCCCCCC=CC(C(COP(=O)(O)O)N)O
- Molecular Formula
- C18H38NO5P
- Molecular Weight
- 379.5000
- Inchikey
- DUYSYHSSBDVJSM-KRWOKUGFSA-N
- Inchi
- InChI=1S/C18H38NO5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(20)17(19)16-24-25(21,22)23/h14-15,17-18,20H,2-13,16,19H2,1H3,(H2,21,22,23)/b15-14+/t17-,18+/m0/s1
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 1.9000
- Num H Donors
- 4
- Num H Acceptors
- 6
- Num Rotatable Bonds
- 17
- Drug Likeness
- Polar Surface Area
- 113.0000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Sphingosine 1-Phosphate
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
Sphingosine 1-Phosphate
Role
preferred
Source
SymMap_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Sym Map
SMIT26901
Pub Chem
5283560
Itcmdb Generated
ITX-INGREDIENT-92BC0623987B
Attributes
Merged source attributes and domain-specific metadata.
Type
Blood ingredients,Metabolic ingredients
Version
v2
Suppress
0
Molecule Formula
C18H38NO5P