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Substance Name: Oxytocin, 1-(N-maleoyl-gly)cys-
RN: 57078-96-3
InChIKey: OHIJPHVVBMSPDN-WANBVXAASA-N

Molecular Weight

  • 1144.29
 
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Names and Synonyms

Name of Substance

  • Oxytocin, 1-(N-maleoyl-gly)cys-

Synonyms

  • 1-(N-Maleoyl-gly)cys-oxytocin
  • OXMGC
  • Oxytocin, 1-(N-maleoylglycyl)cysteine-

Systematic Name

  • Oxytocin, N-((2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)acetyl)-

Registry Numbers

CAS Registry Number

  • 57078-96-3

System Generated Number

  • 0057078963

Structure Descriptors

InChI

1S/C49H69N13O15S2/c1-5-25(4)41-48(76)55-28(12-13-35(50)64)43(71)57-31(19-36(51)65)44(72)59-33(49(77)61-16-6-7-34(61)47(75)58-29(17-24(2)3)42(70)53-20-37(52)66)23-79-78-22-32(54-38(67)21-62-39(68)14-15-40(62)69)46(74)56-30(45(73)60-41)18-26-8-10-27(63)11-9-26/h8-11,14-15,24-25,28-34,41,63H,5-7,12-13,16-23H2,1-4H3,(H2,50,64)(H2,51,65)(H2,52,66)(H,53,70)(H,54,67)(H,55,76)(H,56,74)(H,57,71)(H,58,75)(H,59,72)(H,60,73)/t25-,28-,29-,30-,31-,32-,33-,34?,41?/m0/s1

InChIKey

OHIJPHVVBMSPDN-WANBVXAASA-N

Smiles

NC(=O)CNC(=O)[C@H](CC(C)C)NC([C@@H]1N(CCC1)C([C@H]1NC([C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@H](CSSC1)NC(CN1C(C=CC1=O)=O)=O)Cc1ccc(cc1)O)CCC(N)=O)CC(N)=O)=O)=O)=O