Chemical identity

Uridine Diphosphate Choline (Sodium Salt)

CAS 1772607-47-2 · C14H24N3NaO12P2

01Identity

Identifiers and names for this exact compound. Empty fields are left unassigned.

Lazychem IDLC-30421
PubChem CID168435963
NameUridine Diphosphate Choline (Sodium Salt)
CAS RN1772607-47-2
Molecular formulaC14H24N3NaO12P2
Molecular weight511.29 g/mol
IUPAC nameUridine 5'-(Trihydrogen Diphosphate) P'-[2-(Trimethylammonio)ethyl] Ester Sodium Salt
InChIKeyAYBRGVFIZYNECK-OCMLZEEQSA-M

02Structure identifiers

2D structurePubChem CID 168435963
2D structure: Uridine Diphosphate Choline (Sodium Salt), CAS 1772607-47-2
Structure of Uridine Diphosphate Choline (Sodium Salt) (CAS 1772607-47-2). LazyChem record. Source identity: PubChem CID 168435963. Confirm the identifiers before analytical use.Download structure image

Structure facts for this exact identity.

Molecular formulaC14H24N3NaO12P2
InChIKeyAYBRGVFIZYNECK-OCMLZEEQSA-M
Ring count2
Defined stereocentres4
Unassigned stereocentres2
SMILESC[N+](C)(C)CCOP(=O)([O-])OP(=O)([O-])OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=CC(=O)NC2=O)O)O.[Na+]
InChIInChI=1S/C14H25N3O12P2.Na/c1-17(2,3)6-7-26-30(22,23)29-31(24,25)27-8-9-11(19)12(20)13(28-9)16-5-4-10(18)15-14(16)21;/h4-5,9,11-13,19-20H,6-8H2,1-3H3,(H2-,15,18,21,22,23,24,25);/q;+1/p-1/t9-,11-,12-,13-;/m1./s1

03Stereochemistry

The published structure contains 4 defined and 2 unassigned tetrahedral stereocentres. The exact wedge-and-dash depiction is shown above.

Defined stereocentres42D structure
Unassigned stereocentres22D structure
Assignment statusPartially assignedExact published identity
Tetrahedral upper bound≤ 64Before symmetry reduction

Published same-connectivity configurations

1 record

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.

No additional structure-linked configuration with the same connectivity is currently present in the LazyChem dataset.

Scope: The mathematical 2^n value is only an upper bound. Symmetry and other stereogenic elements can change the number of distinct stereoisomers. A hypothetical configuration is not published as a compound record without a verified structure identity.

04India status for this compound

These results apply only to this exact compound name and CAS number. Confirm the current official instruments before making a regulatory decision.

NDPS / RCSNOT FOUND IN REVIEWED ENTRIESCAS 1772607-47-2 was not found in the reviewed exact-identity entries. Generic, class, analogue, salt and isomer provisions were not evaluated.
SCOMETNOT FOUND IN REVIEWED CAS ENTRIESCAS 1772607-47-2 was not found in the reviewed exact-CAS mapping. Generic and analogue entries were not evaluated.

05Names and relationships

Associated parent compound

Citicoline

View API and impurity family

Other names

  • uridine diphosphate choline sodium salt
  • Uridine Diphosphate Choline (UDPC) Sodium Salt
  • 2-(((((((2R,3S,4R,5R)-5-(2,4-Dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methoxy)(hydroxy)phosphoryl)oxy)oxidophosphoryl)oxy)-N,N,N-trimethylethanaminium sodium salt

Related records from the same parent family

06Documented history

Dated discovery, occurrence, use and issue claims are published only when a suitable primary or government source is available.

No dated history available

No verified discovery, first report, occurrence, use or issue event is currently available for this identity.

07Sources