Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Oxytocin, 1-alpha-mercaptoacetic acid-iso-asn(5)-
RN: 74221-74-2
InChIKey: PACWNYQRLABRFV-QTEKYROGSA-N

Molecular Weight

  • 978.157
 
* 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

  • Oxytocin, 1-alpha-mercaptoacetic acid-iso-asn(5)-

Synonyms

  • 1-alpha-Mercaptoacetic acid-5-iso-asn-oxytocin
  • Maiaspo
  • OXMIA
  • Oxytocin, 1-alpha-mercaptoacetic acid-isoasparagine(5)-

Systematic Name

  • Oxytocin, 1-(mercaptoacetic acid)-5-L-alpha-asparagine-

Registry Numbers

CAS Registry Number

  • 74221-74-2

System Generated Number

  • 0074221742

Structure Descriptors

InChI

1S/C42H63N11O12S2/c1-7-20(4)31(52-37(61)26(48-22(6)54)17-41-12-13-42(65)33(67-42)32(41)66-41)39(63)49-23(10-11-28(43)55)35(59)50-25(16-29(44)56)36(60)47-21(5)40(64)53-14-8-9-27(53)38(62)51-24(15-19(2)3)34(58)46-18-30(45)57/h12-13,19-21,23-27,31,65H,7-11,14-18H2,1-6H3,(H2,43,55)(H2,44,56)(H2,45,57)(H,46,58)(H,47,60)(H,48,54)(H,49,63)(H,50,59)(H,51,62)(H,52,61)/t20-,21-,23-,24-,25-,26-,27-,31-,41?,42?/m0/s1

InChIKey

PACWNYQRLABRFV-QTEKYROGSA-N

Smiles

C(CNC([C@@H](NC([C@H]1N(CCC1)C([C@@H](NC([C@H](CC(=O)N)NC([C@@H](NC([C@@H](NC([C@@H](NC(=O)C)C[C@@]12C(=C3[C@@](O)(C=C1)S3)S2)=O)[C@H](CC)C)=O)CCC(=O)N)=O)=O)C)=O)=O)CC(C)C)=O)(=O)N