KDdiA-PC

CAS
439904-34-4
Catalog Number
ACM439904344
Category
Other Products
Molecular Weight
719.90
Molecular Formula
C36H66NO11P

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Specification

Synonyms
1-Palmitoyl-2-(4-keto-dodec-3-ene-dioyl)phosphatidylcholine
IUPAC Name
[(2R)-2-[(E)-11-carboxy-9-oxoundec-10-enoyl]oxy-3-hexadecanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Canonical SMILES
CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCC(=O)/C=C/C(=O)O
InChI
XWKBYMQTSGGZLW-PHSKOSPPSA-N
InChI Key
InChI=1S/C36H66NO11P/c1-5-6-7-8-9-10-11-12-13-14-15-18-21-24-35(41)45-30-33(31-47-49(43,44)46-29-28-37(2,3)4)48-36(42)25-22-19-16-17-20-23-32(38)26-27-34(39)40/h26-27,33H,5-25,28-31H2,1-4H3,(H-,39,40,43,44)/b27-26+/t33-/m1/s1
Solubility
DMF: .5 mg/mL; DMSO: .5 mg/mL; Ethanol: 30 mg/mL; PBS (pH 7.2): 5 mg/mL
Exact Mass
719.43700
H-Bond Acceptor
9
H-Bond Donor
0
Shipping
Dry ice
Stability
≥1 Year
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