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Substance Name: Angiopeptin
RN: 113294-82-9
InChIKey: RLNIYTXNFXRFKR-ONAWYWRUSA-N

Note

  • Synthetic octapeptide analog of somatostatin; inhibits accelerated transplant atherosclerosis in rabbit heart arteries.

Classification Codes

  • Antineoplastic Agents
  • Cardiovascular Agents

Molecular Formula

  • C54-H71-N11-O10-S2

Molecular Weight

  • 1098.35
 
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Names and Synonyms

Name of Substance

  • Angiopeptin

Synonyms

  • 3-(2-Naphthalenyl)-D-alanyl-L-cysteinyl-L-tyrosyl-D-tryptophyl-L-lysyl-L-valyl-L-cysteinyl-L-threoninamide
  • 3-(2-Naphthyl)-D-ala-cys-tyr-D-trp-lys-val-cys-thr-NH2
  • 3-(2-Naphthyl)alanyl-cystinyl-tyrosyl-tryptophyl-lysyl-valyl-cystinyl-threonine amide
  • Bim 23014 C
  • D-Nal-cys-tyr-trp-lys-val-cys-thr-NH2

Systematic Name

  • L-Threoninamide, 3-(2-naphthalenyl)-D-alanyl-L-cysteinyl-L-tyrosyl-D-tryptophyl-L-lysyl-L-valyl-L-cysteinyl-

Registry Numbers

CAS Registry Number

  • 113294-82-9

System Generated Number

  • 0113294829

Structure Descriptors

InChI

1S/C54H71N11O10S2/c1-3-10-40(49(70)64-45(29-77)54(75)65-46(30(2)66)47(57)68)59-50(71)41(15-8-9-22-55)60-52(73)43(26-35-27-58-39-14-7-6-13-37(35)39)62-51(72)42(25-31-17-20-36(67)21-18-31)61-53(74)44(28-76)63-48(69)38(56)24-32-16-19-33-11-4-5-12-34(33)23-32/h4-7,11-14,16-21,23,27,30,38,40-46,58,66-67,76-77H,3,8-10,15,22,24-26,28-29,55-56H2,1-2H3,(H2,57,68)(H,59,71)(H,60,73)(H,61,74)(H,62,72)(H,63,69)(H,64,70)(H,65,75)/t30-,38-,40+,41+,42+,43-,44+,45+,46+/m1/s1

InChIKey

RLNIYTXNFXRFKR-ONAWYWRUSA-N

Smiles

c1(c[nH]c2c1cccc2)C[C@@H](NC([C@@H](NC([C@@H](NC([C@@H](Cc1ccc2c(c1)cccc2)N)=O)CS)=O)Cc1ccc(cc1)O)=O)C(N[C@H](C(N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H]([C@@H](C)O)C(N)=O)CCC)=O)CCCCN)=O