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
- 62512
- Core Entity Id
- 109530
- Source Entity Count
- 1
- Preferred Name
- 1-O-Octadecyl-Sn-Glycero-3-Phosphocholine
- Name En
- Pubchem Id
- 2733532
- Smiles Canonical
- CCCCCCCCCCCCCCCCCCOCC(COP(=O)([O-])OCC[N+](C)(C)C)O
- Molecular Formula
- C26H56NO6P
- Molecular Weight
- 509.7000
- Inchikey
- XKBJVQHMEXMFDZ-AREMUKBSSA-N
- Inchi
- InChI=1S/C26H56NO6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-31-24-26(28)25-33-34(29,30)32-23-21-27(2,3)4/h26,28H,5-25H2,1-4H3/t26-/m1/s1
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 7.0000
- Num H Donors
- 1
- Num H Acceptors
- 6
- Num Rotatable Bonds
- 26
- Drug Likeness
- Polar Surface Area
- 88.1000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
1-O-Octadecyl-Sn-Glycero-3-Phosphocholine
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
1-O-Octadecyl-Sn-Glycero-3-Phosphocholine
Role
preferred
Source
SymMap_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Sym Map
SMIT20269
Pub Chem
2733532
Itcmdb Generated
ITX-INGREDIENT-66248E69D20F
Attributes
Merged source attributes and domain-specific metadata.
Type
Blood ingredients
Version
v2
Suppress
0
Molecule Formula
C26H56NO6P