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Substance Name: Cargutocin [INN:JAN]
RN: 33605-67-3
UNII: 1RJ33Z503O
InChIKey: YHKWDHMRGAMOKU-DACMYBEBSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Reproductive Effect

Molecular Formula

  • C42-H65-N11-O12

Molecular Weight

  • 916.0405
 
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Names and Synonyms

Name of Substance

  • Cargutocin [INN:JAN]
  • Deaminodicarba-Gly-oxytocin

Synonyms

  • 1-Butanoic acid-7-glycine-1,6-dicarbaoxytocin
  • 1-Buttersaeure-6-(L-2-aminobuttersaeure)-7-glycinoxytocin
  • 1-Butyric acid-6-(L-2-aminobutyric acid)-7-glycine-oxytocin
  • Cargutocin
  • Cargutocina
  • Cargutocina [INN-Spanish]
  • Cargutocine
  • Cargutocine [INN-French]
  • Cargutocinum
  • Cargutocinum [INN-Latin]
  • Deamino-dicarba-(gly(sup 7))-oxytocin
  • Statocin
  • UNII-1RJ33Z503O
  • Y 5350

Systematic Names

  • 1,6-Dicarbaoxytocin, 1-butanoic acid-7-glycine- (9CI)
  • 1-Butanoic acid-7-glycine-1,6-dicarbaoxytocin
  • 1-Butyric acid-6-(L-2-aminobutyric acid)-7-glycineoxytocin
  • Oxytocin, 1-butyric acid-6-(L-2-aminobutyric acid)-7-glycine-

Registry Numbers

CAS Registry Number

  • 33605-67-3

FDA UNII

  • 1RJ33Z503O

Other Registry Number

  • 52773-81-6

System Generated Number

  • 0033605673

Structure Descriptors

InChI

1S/C42H65N11O12/c1-5-23(4)36-42(65)51-27(15-16-31(43)55)39(62)52-30(19-32(44)56)40(63)50-26(37(60)47-21-35(59)49-28(17-22(2)3)38(61)46-20-33(45)57)9-7-6-8-10-34(58)48-29(41(64)53-36)18-24-11-13-25(54)14-12-24/h11-14,22-23,26-30,36,54H,5-10,15-21H2,1-4H3,(H2,43,55)(H2,44,56)(H2,45,57)(H,46,61)(H,47,60)(H,48,58)(H,49,59)(H,50,63)(H,51,65)(H,52,62)(H,53,64)/t23-,26-,27-,28-,29-,30-,36-/m0/s1

InChIKey

YHKWDHMRGAMOKU-DACMYBEBSA-N

Smiles

CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCCC(=O)N[C@H](C(=O)N1)Cc2ccc(cc2)O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N)CC(=O)N)CCC(=O)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intramuscular > 10ku/kg (10000iu/kg)   Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 24, Pg. 695, 1982.
mouse LD50 intraperitoneal > 10ku/kg (10000iu/kg)   Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 24, Pg. 695, 1982.
mouse LD50 intravenous > 5ku/kg (5000iu/kg)   Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 24, Pg. 695, 1982.
mouse LD50 oral > 10ku/kg (10000iu/kg)   Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 24, Pg. 695, 1982.
mouse LD50 subcutaneous > 10ku/kg (10000iu/kg)   Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 24, Pg. 695, 1982.
rat LD50 intramuscular > 5ku/kg (5000iu/kg)   Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 24, Pg. 695, 1982.
rat LD50 intraperitoneal > 10ku/kg (10000iu/kg)   Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 24, Pg. 695, 1982.
rat LD50 intravenous > 5ku/kg (5000iu/kg)   Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 24, Pg. 695, 1982.
rat LD50 oral > 10ku/kg (10000iu/kg)   Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 24, Pg. 695, 1982.
rat LD50 subcutaneous > 10ku/kg (10000iu/kg)   Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 24, Pg. 695, 1982.