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Substance Name: Satoreotide
RN: 1801415-23-5
UNII: S58172SSTS
InChIKey: LBGAPPKREFCCSH-ADPPPVLCSA-N

Molecular Formula

  • C58-H72-Cl-N15-O14-S2

Molecular Weight

  • 1302.8828
 
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Names and Synonyms

Name of Substance

  • Satoreotide

Synonyms

  • D-Tyrosinamide, 4-chloro-L-phenylalanyl-D-cysteinyl-4-((((4S)-hexahydro-2,6-dioxo4-pyrimidinyl)carbonyl)amino)-L-phenylalanyl-4-((aminocarbonyl)amino)-D-phenylalanyl-L-lysyl-L-threonyl-L-cysteinyl-, cyclic (2->7)-disulfide
  • S2,S7-Cyclo(4-chloro-L-phenylalanyl-D-cysteinyl-4-((4S)-2,6-dioxo-1,3-diazinane-4-carboxamido)-L-phenylalanyl-4-(carbamoylamino)-D-phenylalanyl-L-lysyl-L-threonyl-L-cysteinyl-D-tyrosinamide)
  • Satoreotide
  • Satoreotide [INN]
  • UNII-S58172SSTS

Registry Numbers

CAS Registry Number

  • 1801415-23-5

FDA UNII

  • S58172SSTS

System Generated Number

  • 1801415235

Structure Descriptors

InChI

1S/C58H72ClN15O14S2/c1-29(75)47-56(86)71-45(54(84)67-40(48(62)78)23-33-11-19-37(76)20-12-33)28-90-89-27-44(70-49(79)38(61)22-30-5-13-34(59)14-6-30)55(85)69-42(25-31-7-15-35(16-8-31)64-51(81)43-26-46(77)73-58(88)72-43)53(83)68-41(24-32-9-17-36(18-10-32)65-57(63)87)52(82)66-39(50(80)74-47)4-2-3-21-60/h5-20,29,38-45,47,75-76H,2-4,21-28,60-61H2,1H3,(H2,62,78)(H,64,81)(H,66,82)(H,67,84)(H,68,83)(H,69,85)(H,70,79)(H,71,86)(H,74,80)(H3,63,65,87)(H2,72,73,77,88)/t29-,38+,39+,40-,41-,42+,43+,44-,45+,47+/m1/s1

InChIKey

LBGAPPKREFCCSH-ADPPPVLCSA-N

Smiles

C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2ccc(NC(=O)N)cc2)NC(=O)[C@H](Cc3ccc(NC(=O)[C@@H]4CC(=O)NC(=O)N4)cc3)NC(=O)[C@@H](CSSC[C@H](NC1=O)C(=O)N[C@H](Cc5ccc(O)cc5)C(=O)N)NC(=O)[C@@H](N)Cc6ccc(Cl)cc6