Substance Information
| In ZINC since |
Heavy atoms |
Benign functionality |
| April 27th, 2011 |
35 |
No
|
Other Names:
(2R)-2-hydroxy-3-[(9E)-octadec-9-enoyloxy]propyl 2-(trimethylammonio)ethyl phosphate; (4R,7R,18E)-4,7-dihydroxy-N,N,N-trimethyl-10-oxo-3,5,9-trioxa-4-phosphaheptacos-18-en-1-aminium 4-oxide
1-(9E-octadecenoyl)-sn-glycero-3-phosphocholine
1-(9Z-octadecenoyl)-sn-glycero-3-phosphocholine; 1-Oleoyl-sn-glycero-3-phosphocholine; 1-Oleoylglycerophosphocholine; Choline phosphate (ester) 3-ester with 1-monoolein; Choline phosphate 3-ester with 1-monoolein; GPCho(18:1(9Z)/0:0)[rac]; LPC(18:1n9/0:0)
1-elaidoyl-sn-glycero-3-phosphocholine
3,5,9-Trioxa-4-phosphaheptacos-18-en-1-aminium, 4,7-dihydroxy-N,N,N-trimethyl-10-oxo-, inner salt, 4-oxide, [R-(E)]-; PC(18:1/0:0)
PC(18:1(9E)/0:0)
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SMILES
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Physical Representations
|
Type
pH range
|
xlogP
|
Des A‑Pol
Apolar desolvation
(kcal/mol)
|
Des Pol
Polar desolvation
(kcal/mol)
|
H Don
H-bond donors
|
H Acc
H-bond acceptors
|
Chg
Net charge
|
tPSA
(Ų)
|
MWT
Molecular weight
(g/mol)
|
RB
Rotatable bonds
|
DL |
|
Ref
Reference (pH 7)
|
2.28 |
17.18 |
-50.86 |
1 |
8 |
0 |
105 |
521.676 |
25 |
↓
|
No pre-computed analogs available. Try a structural similarity search.
