![Chemical structure of 3,5,9-Trioxa-4-phosphapentacosan-1-aminium,4-hydroxy-N,N,N-trimethyl-10-oxo-7-[(1-oxohexadecyl)oxy]-, inner salt,4-oxide, (7R)-, CAS 63-89-8](https://api.angenesci.com/assets/img/none.png)
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| CAS Number | 63-89-8 |
| Catalog Number | AG003DER(AGN-PC-0TADZG) |
| Chemical Name | 3,5,9-Trioxa-4-phosphapentacosan-1-aminium,4-hydroxy-N,N,N-trimethyl-10-oxo-7-[(1-oxohexadecyl)oxy]-, inner salt,4-oxide, (7R)- |
| EC Number | 200-567-6 |
| IUPAC Name | [(2R)-2,3-di(hexadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate |
| InChI | InChI=1S/C40H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-39(42)46-36-38(37-48-50(44,45)47-35-34-41(3,4)5)49-40(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3/t38-/m1/s1 |
| InChI Key | KILNVBDSWZSGLL-KXQOOQHDSA-N |
| MDL Number | MFCD00036903 |
| Molecular Formula | C40H80NO8P |
| Molecular Weight | 734.0389 |
| SMILES | O=P(OC[C@H](OC(CCCCCCCCCCCCCCC)=O)COC(CCCCCCCCCCCCCCC)=O)([O-])OCC[N+](C)(C)C |
| UNII | 319X2NFW0A |
| Synonyms | 1,2-dipalmitoyl-sn-glycero-3-phosphocholine,
colfosceril palmitate,
63-89-8,
DPPC,
1,2-Dipalmitoyl-sn-glycero-3-phosphocholine,
Colfosceril palmitate,
1,2-Dipalmitoyl-L-lecithin,
1,2-dihexadecanoyl-sn-glycero-3-phosphocholine,
Colfoscerili palmitas,
diPalmitoylphosphatidylcholine,
PC(16:0/16:0),
Palmitate de colfosceril,
Palmitato de colfoscerilo,
UNII-319X2NFW0A,
(R)-2,3-Bis(palmitoyloxy)propyl (2-(trimethylammonio)ethyl) phosphate,
Phosphatidylcholine(32:0),
PC(32:0),
319X2NFW0A,
CHEBI:72999,
1,2-Dipalmitoyl-sn-glycero-3-phosphorylcholine,
KILNVBDSWZSGLL-KXQOOQHDSA-N,
Phosphatidylcholine(16:0/16:0),
Dipalmitoyl phosphatidylcholine,
MFCD00036903,
1-16:0-2-16:0-phosphatidylcholine,
PC 32:0,
129Y83,
16:0-16:0-PC,
1,2-Dihexadecanoyl-sn-glycero-3-phosphorylcholine,
1,2-Dipalmitoyl-3-sn-phosphatidylcholine,
1,2-DIPALMITOYLPHOSPHATIDYLCHOLINE,
(7R)-4-Hydroxy-N,N,N-trimethyl-10-oxo-7-[(1-oxohexadecyl)oxy]- 3,5,9-trioxa-4-phosphapentacosan-1-aminium 4-oxide, inner salt,
L-|A,|A-Dipalmitoyl-|A-lecithin,
L-a-Dipalmitoyl lecithin,
L-Dipalmitoyl lecithin,
C40H80NO8P,
dipalmitoyl-GPC,
Colfoscerilpalmitat,
Colfoscerili palmitas [INN-Latin],
L-alpha-DPPC,
EINECS 200-567-6,
L-alpha-dipalmitoyl phosphatidylcholine,
Palmitate de colfosceril [INN-French],
Colfosceril palmitate [USAN:INN:BAN],
L-a-Dipalmitoylecithin,
L-a-Dipalmitoyllecithin,
Palmitato de colfoscerilo [INN-Spanish],
L-a-DPPC,
L-DPPC,
sn-3-Dipalmitoyllecithin,
Dipalmitoyl-L-a-lecithin,
L-alpha-Dipalmitoylecithin,
NCGC00167568-01,
L-alpha-Dipalmitoyllecithin,
Dipalmitoyl-L-alpha-lecithin,
DSSTox_CID_26720,
DSSTox_RID_81850,
DSSTox_GSID_46720,
SCHEMBL24980,
L-b,g-Dipalmitoyl-a-lecithin,
MLS000028586,
Dipalmitoyl-phosphatidylcholine,
1,2-Dipalmitoyl-L-a-lecithin,
2,3-Bis(palmitoyloxy)propyl [2-(Trimethylammonio)ethyl] Phosphate,
L-1,2-Dipalmitoyl-a-lecithin,
L-a-1,2-Dipalmitoyl lecithin,
AC1L9Q36,
CHEMBL1200737,
DTXSID5046720,
b,g-Dipalmitoyl-L-(a)-lecithin,
L-a-Dipalmitoylphosphatidylcholine,
L-b,g-Dipalmitoyl-alpha-lecithin,
phosphatidylcholine 16:0/16:0,
1,2-Dipalmitoyl-L-alpha-lecithin,
Colfosceril palmitate (USAN/INN),
HMS2231H14,
HMS3650O14,
L-1,2-Dipalmitoyl-alpha-lecithin,
L-alpha-1,2-Dipalmitoyl lecithin,
Dipalmitoyl L-a-phosphatidylcholine,
Dipalmitoyl-L-a-phosphatidylcholine,
1,2-dipalmitoyl-phosphatidylcholine,
KS-000015BO,
L-b,g-Dipalmitoylphosphatidylcholine,
Dipalmitoyl-sn-3-phosphatidylcholine,
Tox21_112563,
b,g-Dipalmitoyl-L-phosphatidylcholine,
L-1,2-Dipalmitoylphosphatidylcholine,
L-alpha-Dipalmitoylphosphatidylcholine,
LMGP01010564,
L-|A-Phosphatidylcholine, dipalmitoyl,
1,2-Dipalmitoyl-L-phosphatidylcholine,
AKOS016013969,
Dipalmitoyl L-alpha-phosphatidylcholine,
Dipalmitoyl-L-alpha-phosphatidylcholine,
1,2-Dipalmitoyl-sn-phosphatidylcholine,
1,2-L-a-Dipalmitoylphosphatidylcholine,
b,g-Dipalmitoyl L-a-phosphatidylcholine,
DB09114,
L-b,g-Dipalmitoyl-a-phosphatidylcholine,
L-beta,gamma-Dipalmitoyl-alpha-lecithin,
(R)-(4-Oxido-10-oxo-7-palmitoyl-3,5,9-trioxa-4-phosphapentacosyl)trimethylammonium 4-oxide,
1,2-Dipalmitoylglycero-3-phosphocholine,
CAS-63-89-8,
Choline hydroxide, dihydrogen phosphate, inner salt, ester with L-1,2-dipalmitin,
L-alpha-Phosphatidylcholine, dipalmitoyl,
1,2-Dipalmitoyl-L-3-phosphatidylcholine,
1,2-Dipalmitoyl-L-a-phosphatidylcholine,
1,2-Dipalmitoyl-sn-glycerophosphocholine,
Dipalmitoyl-L-3-glycerylphosphorylcholine,
3,5,9-Trioxa-4-phosphapentacosan-1-aminium, 4-hydroxy-N,N,N-trimethyl-10-oxo-7-[(1-oxohexadecyl)oxy]-, inner salt, 4-oxide, (7R)-,
AK129753,
Dihexadecanoyl-sn-glycero-3-phosphocholine,
K017,
SMR000058951,
1,2-L-alpha-Dipalmitoylphosphatidylcholine,
1,2-Dipalmitoyl-L-alpha-phosphatidylcholine,
1,2-Dipalmitoyl-sn-3-glycerophosphocholine,
1,2-Dipalmitoyl-sn-glycerophosphorylcholine,
b,g-Dipalmitoyl L-alpha-phosphatidylcholine,
GPC(16:0/16:0),
HY-109506,
L-b,g-Dipalmitoyl-alpha-phosphatidylcholine,
CS-0031214,
D3925,
FT-0603263,
1,2-Dipalmitoyl-sn-glycerol-3-phosphocholine,
1,2-Dipalmitoyl-sn-glyceryl-3-phosphocholine,
L-alpha-Dipalmitoyl phosphatidylcholine, 98%,
D03585,
1,2-Bis(palmitoyl)-sn-glycero-3-phosphocholine,
1,2-dipalmitoyl-sn-glycero-3-Phosphatidylcholine,
1,2-Bis(hexadecanoyl)-sn-glycero-3-phosphocholine,
1,2-Dihexadecanoyl-sn-glycerol-3-phosphorylcholine,
C-23476,
UNII-1T6N4D9YV6 component KILNVBDSWZSGLL-KXQOOQHDSA-N,
UNII-2W15RT5V7V component KILNVBDSWZSGLL-KXQOOQHDSA-N,
1,2-Dipalmitoyl-sn-glycero-3-phosphocholine, >=99% (TLC),
(R)-2,3-bis(palmitoyloxy)propyl 2-(trimethylammonio)ethyl phosphate,
1,2-Dipalmitoyl-sn-glycero-3-phosphocholine, semisynthetic, >=99%,
(2R)-2,3-bis(hexadecanoyloxy)propyl 2-(trimethylammonio)ethyl phosphate,
(2R)-2,3-bis(hexadecanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate,
[(2R)-2,3-di(hexadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate,
16:0 PC (DPPC), 1,2-dipalmitoyl-sn-glycero-3-phosphocholine, powder,
2-[[(2R)-2,3-di(hexadecanoyloxy)propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium,
(R)-4-hydroxy-N,N,N-trimethyl-10-oxo-7-[(1-oxohexadecyl)oxy]-3,5,9-Trioxa-4-phosphapentacosan-1-aminium 4-oxide hydroxide inner salt,
(R)-4-hydroxy-N,N,N-trimethyl-10-oxo-7-[(1-oxohexadecyl)oxy]-3,5,9-Trioxa-4-phosphapentacosan-1-aminium 4-oxide inner salt,
3,5,9-Trioxa-4-phosphapentacosan-1-aminium, 4-hydroxy-N,N,N-trimethyl-10-oxo-7-((1-oxohexadecyl)oxy)-, hydroxide, inner salt, 4-oxide, (R)-,
Exosurf,
LECITHIN,
L-alpha-dipalmitoyl lecithin,
GPCho(32:0),
PC aa C32:0,
GPCho(16:0/16:0),
C40-H80-N-O8-P,
CID452110,
Colfosceril palmitate [USAN:BAN:INN],
1,2-Dipalmitoyl-rac-glycero-3-phosphocholine,
1,2-DIACYL-SN-GLYCERO-3-PHOSHOCHOLINE,
1,2-Dipalmitoyl-sn-glycero-3-phosphocholine, 98% - 25MG 25mg,
2644-64-6,
|
| Complexity | 826 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 733.562g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 50 |
| Hydrogen Bond Acceptor Count | 8 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 734.053g/mol |
| Monoisotopic Mass | 733.562g/mol |
| Rotatable Bond Count | 40 |
| Topological Polar Surface Area | 111A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 13.5 |
| Symbol: | |
| Hazard Class | |
| Hazard statements | H302-H315-H319-H335 |
| Packing Group | |
| Precautionary statements | P261-P305+P351+P338 |
| UN Code |
| Chemical Name: | Batch Number: | |
| Chemical Structure: | CAS Registry No: | |
| Product ID: | ||
| Manufacture Date: | ||
| Storage Temperature: | ||
| Formula: | ||
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| Test: | Result: |

