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Organic oxoanionic compounds

Organic compounds that contain a carbon backbone with an oxygen anion (anions are ions with a net negative charge).

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1

Thermo Scientific Chemicals L-alpha-Lecithin, granular, from soybean oil

CAS: 8002-43-5 Molecular Formula: C42H80NO8P Molecular Weight (g/mol): 750 MDL Number: MFCD00082428 InChI Key: JLPULHDHAOZNQI-JLOPVYAASA-N Synonym: 3-sn-phosphatidylcholine,1-hexadecanoyl-2-9e,12e-octadecadienoyl-sn-glycero-3-phosphocholine,1,2-diacyl-sn-glycero-3-phosphocholine,3,5,8-trioxa-4-phosphahexacosa-17,20-dien-1-aminium, 4-hydroxy-n,n,n-trimethyl-9-oxo-7-1-oxohexadecyl oxy methyl-, inner salt, 4-oxide, r,l-,a-lecithin,2-linoleoyl-1-palmitoyl-sn-glycero-3-phosphocholine,a-phosphatidylcholine solution,l-alpha-phosphatidylcholine solution,2-linoleoyl-1-palmitoyl-sn-glyc-ero-3-phosphocholine PubChem CID: 16213884 ChEBI: CHEBI:86658 IUPAC Name: [(2R)-3-hexadecanoyloxy-2-[(9E,12E)-octadeca-9,12-dienoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate SMILES: CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCC=CCC=CCCCCC

EDGE
PubChem CID 16213884
CAS 8002-43-5
Molecular Weight (g/mol) 750
ChEBI CHEBI:86658
MDL Number MFCD00082428
SMILES CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCC=CCC=CCCCCC
Synonym 3-sn-phosphatidylcholine,1-hexadecanoyl-2-9e,12e-octadecadienoyl-sn-glycero-3-phosphocholine,1,2-diacyl-sn-glycero-3-phosphocholine,3,5,8-trioxa-4-phosphahexacosa-17,20-dien-1-aminium, 4-hydroxy-n,n,n-trimethyl-9-oxo-7-1-oxohexadecyl oxy methyl-, inner salt, 4-oxide, r,l-,a-lecithin,2-linoleoyl-1-palmitoyl-sn-glycero-3-phosphocholine,a-phosphatidylcholine solution,l-alpha-phosphatidylcholine solution,2-linoleoyl-1-palmitoyl-sn-glyc-ero-3-phosphocholine
IUPAC Name [(2R)-3-hexadecanoyloxy-2-[(9E,12E)-octadeca-9,12-dienoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
InChI Key JLPULHDHAOZNQI-JLOPVYAASA-N
Molecular Formula C42H80NO8P
2

Thermo Scientific Chemicals Cytidine-5'-diphosphocholine sodium salt

CAS: 33818-15-4 Molecular Formula: C14H25N4NaO11P2 Molecular Weight (g/mol): 510.31 MDL Number: MFCD00150508 InChI Key: YWAFNFGRBBBSPD-OCMLZEEQSA-M Synonym: citicolinesodium,cytidine 5'-diphosphocholine sodium,cdp-choline sodium,citicoline, sodium,cdp-choline, sodium,cytidine 5'-diphosphocholine sodium salt,cytidine 5'-diphosphocholine sodium salt dihydrate,cytidine-5'-diphosphocholine monosodium salt,sodium 2s,3r,4s,5s-5-4-amino-2-oxo-1-pyrimidinyl-3,4-dihydroxy-2-oxolanyl methoxy-oxidophosphoryl 2-trimethylammonio ethyl phosphate,sodium 2s,3r,4s,5s-5-4-azanyl-2-oxidanylidene-pyrimidin-1-yl-3,4-bis oxidanyl oxolan-2-yl methoxy-oxidanidyl-phosphoryl 2-trimethylazaniumyl ethyl phosphate PubChem CID: 46738085 IUPAC Name: sodium;[[(2S,3R,4S,5S)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl] 2-(trimethylazaniumyl)ethyl phosphate SMILES: [Na+].C[N+](C)(C)CCOP([O-])(=O)OP([O-])(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=CC(N)=NC1=O

PubChem CID 46738085
CAS 33818-15-4
Molecular Weight (g/mol) 510.31
MDL Number MFCD00150508
SMILES [Na+].C[N+](C)(C)CCOP([O-])(=O)OP([O-])(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=CC(N)=NC1=O
Synonym citicolinesodium,cytidine 5'-diphosphocholine sodium,cdp-choline sodium,citicoline, sodium,cdp-choline, sodium,cytidine 5'-diphosphocholine sodium salt,cytidine 5'-diphosphocholine sodium salt dihydrate,cytidine-5'-diphosphocholine monosodium salt,sodium 2s,3r,4s,5s-5-4-amino-2-oxo-1-pyrimidinyl-3,4-dihydroxy-2-oxolanyl methoxy-oxidophosphoryl 2-trimethylammonio ethyl phosphate,sodium 2s,3r,4s,5s-5-4-azanyl-2-oxidanylidene-pyrimidin-1-yl-3,4-bis oxidanyl oxolan-2-yl methoxy-oxidanidyl-phosphoryl 2-trimethylazaniumyl ethyl phosphate
IUPAC Name sodium;[[(2S,3R,4S,5S)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl] 2-(trimethylazaniumyl)ethyl phosphate
InChI Key YWAFNFGRBBBSPD-OCMLZEEQSA-M
Molecular Formula C14H25N4NaO11P2
4

(4-Amino-2-methylpyrimidin-5-yl)methyl Trihydrogen Diphosphate, TRC

CAS: 841-01-0 Molecular Formula: C6H11N3O7P2 Molecular Weight (g/mol): 299.11 IUPAC Name: (4-amino-2-methylpyrimidin-5-yl)methyl phosphono hydrogen phosphate SMILES: Cc1ncc(COP(=O)(O)OP(=O)(O)O)c(N)n1

CAS 841-01-0
Molecular Weight (g/mol) 299.11
SMILES Cc1ncc(COP(=O)(O)OP(=O)(O)O)c(N)n1
IUPAC Name (4-amino-2-methylpyrimidin-5-yl)methyl phosphono hydrogen phosphate
Molecular Formula C6H11N3O7P2
5

Tetrabenzyl Pyrophosphate, TRC

CAS: 990-91-0 Molecular Formula: C28 H28 O7 P2 Molecular Weight (g/mol): 538.47 Synonym: Diphosphoric Acid P,P,P',P'-Tetrakis(phenylmethyl) Ester,Benzyl Pyrophosphate,Tetrabenzyl Diphosphate IUPAC Name: dibenzyl bis(phenylmethoxy)phosphoryl phosphate SMILES: O=P(OCc1ccccc1)(OCc2ccccc2)OP(=O)(OCc3ccccc3)OCc4ccccc4

CAS 990-91-0
Molecular Weight (g/mol) 538.47
SMILES O=P(OCc1ccccc1)(OCc2ccccc2)OP(=O)(OCc3ccccc3)OCc4ccccc4
Synonym Diphosphoric Acid P,P,P',P'-Tetrakis(phenylmethyl) Ester,Benzyl Pyrophosphate,Tetrabenzyl Diphosphate
IUPAC Name dibenzyl bis(phenylmethoxy)phosphoryl phosphate
Molecular Formula C28 H28 O7 P2
6

2-(N-Hexadecanoylamino)-4-nitrophenylphosphocholine Hydroxide, TRC

CAS: 60438-73-5 Molecular Formula: C27 H49 N3 O7 P . H O Molecular Weight (g/mol): 575.68 IUPAC Name: 2-[[2-(hexadecanoylamino)-4-nitrophenoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium;hydroxide SMILES: [OH-].CCCCCCCCCCCCCCCC(=O)Nc1cc(ccc1OP(=O)(O)OCC[N+](C)(C)C)[N+](=O)[O-]

CAS 60438-73-5
Molecular Weight (g/mol) 575.68
SMILES [OH-].CCCCCCCCCCCCCCCC(=O)Nc1cc(ccc1OP(=O)(O)OCC[N+](C)(C)C)[N+](=O)[O-]
IUPAC Name 2-[[2-(hexadecanoylamino)-4-nitrophenoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium;hydroxide
Molecular Formula C27 H49 N3 O7 P . H O
7

n-Dodecylphosphocholine, CDN

Discover 4000+ high-quality deuterated compounds, shipping directly from stock for speed. We offer many unique API’s, including active pharmaceutical ingredients, nitrosoamines, amino acids, steroids, gases, pesticides, and fatty acids.

8

n-Tetradecylphosphocholine, CDN

Discover 4000+ high-quality deuterated compounds, shipping directly from stock for speed. We offer many unique API’s, including active pharmaceutical ingredients, nitrosoamines, amino acids, steroids, gases, pesticides, and fatty acids.