Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1-Oleoyl-2-(12-((7-nitro-2,1,3-benzoxadiazol-4-yl)amino)dodecanoyl)phosphatidylcholine
RN: 131479-28-2
InChIKey: DLMNHXAJBHZYME-SEYXRHQNSA-N

Molecular Formula

  • C44-H76-N5-O11-P

Molecular Weight

  • 882.082
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • 1-Oleoyl-2-(12-((7-nitro-2,1,3-benzoxadiazol-4-yl)amino)dodecanoyl)phosphatidylcholine

Synonym

  • C12-Nbd-PC

Systematic Name

  • 3,5,9-Trioxa-4-phosphaheptacos-18-en-1-aminium, 4-hydroxy-N,N,N-trimethyl-7-((12-((7-nitro-4-benzofurazanyl)amino)-1-oxododecyl)oxy)-10-oxo-, hydroxide, inner salt, 4-oxide, (Z)-

Registry Numbers

CAS Registry Number

  • 131479-28-2

System Generated Number

  • 0131479282

Structure Descriptors

InChI

1S/C44H76N5O11P/c1-5-6-7-8-9-10-11-12-13-14-15-17-20-23-26-29-41(50)56-36-38(37-58-61(54,55)57-35-34-49(2,3)4)59-42(51)30-27-24-21-18-16-19-22-25-28-33-45-39-31-32-40(48(52)53)44-43(39)46-60-47-44/h12-13,31-32,38H,5-11,14-30,33-37H2,1-4H3,(H-,45,47,54,55)/b13-12-

InChIKey

DLMNHXAJBHZYME-SEYXRHQNSA-N

Smiles

C(COP(OC[C@@H](COC(CCCCCCC\C=C/CCCCCCCC)=O)OC(CCCCCCCCCCCNc1c2nonc2c(cc1)[N+](=O)[O-])=O)(=O)[O-])[N+](C)(C)C