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Substance Name: Cinnamycin
RN: 110655-58-8
InChIKey: QJDWKBINWOWJNZ-IDGBIKHQSA-N

Note

  • Isolated from Streptoverticillium griseoverticillatum; contains 15 amino acids.

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C89-H125-N25-O25-S3

Molecular Weight

  • 2041.31
 
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Names and Synonyms

Name of Substance

  • Cinnamycin
  • Lanthiopeptin

Synonyms

  • Antibiotic NSC-71936
  • Lanthiopeptin
  • NSC 71936
  • NSC-71936
  • Ro 09-0198
  • Ro-09-0198

Systematic Names

  • Cinnamycin
  • Lysine, cysteinylarginylglutaminylcysteinylcysteinylphenylalanylphenylalanylglycylprolyl-3-aminoalanyl-3-mercapto-2-aminobutanoylphenylalanylvalylcysteinyl-3-hydroxy-alpha-aspartylglycylasparaginyl-3-mercapto-2-aminobutanoyl-, cyclic (1-18),(4-14), (5-11)-tris(sulfide), cyclic (10-19)-imine

Registry Numbers

CAS Registry Number

  • 110655-58-8

Other Registry Number

  • 1405-39-6

System Generated Number

  • 0110655588

Structure Descriptors

InChI

1S/C89H125N25O25S3/c1-43(2)66-84(133)109-59-41-140-40-58-79(128)108-60-42-142-45(4)68(86(135)105-55(75(124)110-66)34-48-22-12-7-13-23-48)111-76(125)54(33-47-20-10-6-11-21-47)104-82(131)61-26-17-31-114(61)65(118)38-98-72(121)53(32-46-18-8-5-9-19-46)103-78(127)57(106-80(60)129)36-95-29-15-14-24-52(87(136)137)102-85(134)67(112-77(126)56(35-63(92)116)99-64(117)37-97-83(132)69(113-81(59)130)70(119)88(138)139)44(3)141-39-49(90)71(120)100-50(25-16-30-96-89(93)94)73(122)101-51(74(123)107-58)27-28-62(91)115/h5-13,18-23,43-45,49-61,66-70,95,119H,14-17,24-42,90H2,1-4H3,(H2,91,115)(H2,92,116)(H,97,132)(H,98,121)(H,99,117)(H,100,120)(H,101,122)(H,102,134)(H,103,127)(H,104,131)(H,105,135)(H,106,129)(H,107,123)(H,108,128)(H,109,133)(H,110,124)(H,111,125)(H,112,126)(H,113,130)(H,136,137)(H,138,139)(H4,93,94,96)/t44-,45?,49+,50+,51+,52+,53+,54+,55+,56+,57+,58+,59+,60+,61+,66+,67?,68+,69+,70-/m1/s1

InChIKey

QJDWKBINWOWJNZ-IDGBIKHQSA-N

Smiles

N12[C@H](C(N[C@@H](Cc3ccccc3)C(N[C@@H]3C(N[C@@H](Cc4ccccc4)C(N[C@H](C(N[C@@H]4C(N[C@H](C(NCC(=O)N[C@H](C(N[C@@H]5C(N[C@@H](CCCCNC[C@@H](C(N[C@H](C(NCC2=O)=O)Cc2ccccc2)=O)NC(=O)[C@H](CS[C@H]3C)NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](N)CS[C@@H]5C)=O)CCCNC(N)=N)=O)CCC(N)=O)=O)CSC4)=O)C(O)=O)=O)=O)CC(N)=O)=O)[C@H](C(O)=O)O)=O)=O)C(C)C)=O)=O)=O)=O)CCC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 2mg/kg (2mg/kg)   "CRC Handbook of Antibiotic Compounds," Vols.1- , Berdy, J., Boca Raton, FL, CRC Press, 1980Vol. 4(1), Pg. 249, 1980.
mouse LD50 intravenous 2500ug/kg (2.5mg/kg)   "CRC Handbook of Antibiotic Compounds," Vols.1- , Berdy, J., Boca Raton, FL, CRC Press, 1980Vol. 4(1), Pg. 249, 1980.
mouse LD50 subcutaneous 400mg/kg (400mg/kg)   "CRC Handbook of Antibiotic Compounds," Vols.1- , Berdy, J., Boca Raton, FL, CRC Press, 1980Vol. 4(1), Pg. 249, 1980.