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Substance Name: 1-5-beta-Neoendorphin (human), 6-ester with D-glucose
RN: 133733-37-6
InChIKey: WDONICSJKNKDCQ-CWDJXBEVSA-N

Molecular Formula

  • C34-H47-N5-O12

Molecular Weight

  • 717.7683
 
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Names and Synonyms

Synonyms

  • (5-Leu)enkephalin-related
  • 6-(Tyrosylglycylglycylphenylalanylleucyl)-D-glucopyranose
  • L-Leucine, N-(N-(N-(N-L-tyrosylglycyl)glycyl)-L-phenylalanyl)-, 6-ester with D-glucose

Systematic Name

  • 1-5-beta-Neoendorphin (human), 6-ester with D-glucose

Registry Numbers

CAS Registry Number

  • 133733-37-6

System Generated Number

  • 0133733376

Structure Descriptors

InChI

1S/C34H47N5O12/c1-19(2)12-25(34(50)51-18-27(43)31(47)30(46)26(42)17-40)39-33(49)24(14-20-6-4-3-5-7-20)38-29(45)16-36-28(44)15-37-32(48)23(35)13-21-8-10-22(41)11-9-21/h3-11,17,19,23-27,30-31,41-43,46-47H,12-16,18,35H2,1-2H3,(H,36,44)(H,37,48)(H,38,45)(H,39,49)/t23-,24-,25-,26-,27+,30+,31+/m0/s1

InChIKey

WDONICSJKNKDCQ-CWDJXBEVSA-N

Smiles

CC(C)C[C@@H](C(=O)OC[C@H]([C@H]([C@@H]([C@H](C=O)O)O)O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@H](Cc2ccc(cc2)O)N