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Substance Name: 1-5-b-Neoendorphin (human), 1-(O-b-D-glucopyranosyl-L-tyrosine)-
RN: 113282-58-9
InChIKey: VXRUUPYSOOPEDW-WKGWLEJISA-N

Molecular Formula

  • C34-H47-N5-O12

Molecular Weight

  • 717.7683
 
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Names and Synonyms

Synonyms

  • (5-Leu)enkephalin-related
  • L-Leucine, N-(N-(N-(N-(O-b-D-glucopyranosyl-L-tyrosyl)glycyl)glycyl)-L-phenylalanyl)-
  • O-beta-D-Glucopyranosyltyrosylglycylglycylphenylalanylleucine

Systematic Name

  • 1-5-b-Neoendorphin (human), 1-(O-b-D-glucopyranosyl-L-tyrosine)-

Registry Numbers

CAS Registry Number

  • 113282-58-9

System Generated Number

  • 0113282589

Structure Descriptors

InChI

1S/C34H47N5O12/c1-18(2)12-24(33(48)49)39-32(47)23(14-19-6-4-3-5-7-19)38-27(42)16-36-26(41)15-37-31(46)22(35)13-20-8-10-21(11-9-20)50-34-30(45)29(44)28(43)25(17-40)51-34/h3-11,18,22-25,28-30,34,40,43-45H,12-17,35H2,1-2H3,(H,36,41)(H,37,46)(H,38,42)(H,39,47)(H,48,49)/t22-,23-,24-,25+,28+,29-,30+,34+/m0/s1

InChIKey

VXRUUPYSOOPEDW-WKGWLEJISA-N

Smiles

CC(C)C[C@@H](C(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@H](Cc2ccc(cc2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)N