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Substance Name: Delmitide acetate [USAN]
RN: 501019-16-5
UNII: 5Y1CNW44Y5
InChIKey: LTDMAMSELCSERL-XCQJOGLYSA-N

Classification Code

  • Treatment of Chemotherapy-Induced Diarrhea (CID)

Molecular Formula

  • C59-H105-N17-O11

Molecular Weight

  • 1288.6381
 
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Names and Synonyms

Name of Substance

  • Delmitide acetate [USAN]

Synonyms

  • D-Arginyl-(2R)-2-aminohexyanoyl-(2R)-2-aminohexyanoyl-(2R)-2-aminohexyanoyl-D-arginyl-(2R)-2-aminohexyanoyl-(2R)-2-aminohexyanoyl-(2R)-2-aminohexyanoylglycyl-D-tyranosinamide monoacetate
  • Delmitide acetate
  • RSP58
  • UNII-5Y1CNW44Y5

Systematic Name

  • D-Tyrosinamide, D-arginyl-D-norleucyl-D-norleucyl-D-norleucyl-D-arginyl-D-norleucyl-D-norleucyl-D-norleucylglycyl-, acetate

Registry Numbers

CAS Registry Number

  • 501019-16-5

FDA UNII

  • 5Y1CNW44Y5

System Generated Number

  • 0501019165

Structure Descriptors

InChI

1S/C59H105N17O11.C2H4O2/c1-7-13-22-40(51(81)68-36-48(78)69-47(49(61)79)35-37-29-31-38(77)32-30-37)71-53(83)42(24-15-9-3)73-55(85)44(26-17-11-5)75-57(87)46(28-20-34-67-59(64)65)76-56(86)45(27-18-12-6)74-54(84)43(25-16-10-4)72-52(82)41(23-14-8-2)70-50(80)39(60)21-19-33-66-58(62)63;1-2(3)4/h29-32,39-47,77H,7-28,33-36,60H2,1-6H3,(H2,61,79)(H,68,81)(H,69,78)(H,70,80)(H,71,83)(H,72,82)(H,73,85)(H,74,84)(H,75,87)(H,76,86)(H4,62,63,66)(H4,64,65,67);1H3,(H,3,4)/t39-,40-,41-,42-,43-,44-,45-,46-,47-;/m1./s1

InChIKey

LTDMAMSELCSERL-XCQJOGLYSA-N

Smiles

CCCC[C@H](C(=O)N[C@H](CCCC)C(=O)N[C@H](CCCC)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H](CCCC)C(=O)N[C@H](CCCC)C(=O)N[C@H](CCCC)C(=O)NCC(=O)N[C@H](Cc1ccc(cc1)O)C(=O)N)NC(=O)[C@@H](CCCNC(=N)N)N.CC(=O)O