(6S,9S,12S,15S,18R,21S)-1,1-diamino-6-((S)-2-(((2S,3R)-1-(((S)-1-(((S)-6-amino-1-(((1S,2R)-1-carboxy-2-hydroxypropyl)amino)-1-oxohexan-2-yl)amino)-4-carboxy-1-oxobutan-2-yl)amino)-3-hydroxy-1-oxobutan-2-yl)carbamoyl)pyrrolidine-1-carbonyl)-21-((S)-2-amino-3-methylbutanamido)-15-benzyl-9-(hydroxymethyl)-12-isobutyl-18-(mercaptomethyl)-8,11,14,17,20-pentaoxo-2,7,10,13,16,19-hexaazatricos-1-en-23-oic acid

Catalog No. :
ACSYBF137
CAS No. :
916977-43-0
Molecular Formula :
C60H98N16O20S
Molecular Weight :
1395.60

IUPAC Name:(6S,9S,12S,15S,18R,21S)-1,1-diamino-6-((S)-2-(((2S,3R)-1-(((S)-1-(((S)-6-amino-1-(((1S,2R)-1-carboxy-2-hydroxypropyl)amino)-1-oxohexan-2-yl)amino)-4-carboxy-1-oxobutan-2-yl)amino)-3-hydroxy-1-oxobutan-2-yl)carbamoyl)pyrrolidine-1-carbonyl)-21-((S)-2-amino-3-methylbutanamido)-15-benzyl-9-(hydroxymethyl)-12-isobutyl-18-(mercaptomethyl)-8,11,14,17,20-pentaoxo-2,7,10,13,16,19-hexaazatricos-1-en-23-oic acid

(6S,9S,12S,15S,18R,21S)-1,1-diamino-6-((S)-2-(((2S,3R)-1-(((S)-1-(((S)-6-amino-1-(((1S,2R)-1-carboxy-2-hydroxypropyl)amino)-1-oxohexan-2-yl)amino)-4-carboxy-1-oxobutan-2-yl)amino)-3-hydroxy-1-oxobutan-2-yl)carbamoyl)pyrrolidine-1-carbonyl)-21-((S)-2-amino-3-methylbutanamido)-15-benzyl-9-(hydroxymethyl)-12-isobutyl-18-(mercaptomethyl)-8,11,14,17,20-pentaoxo-2,7,10,13,16,19-hexaazatricos-1-en-23-oic acid structure diagram
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Product Information

Product Name(6S,9S,12S,15S,18R,21S)-1,1-diamino-6-((S)-2-(((2S,3R)-1-(((S)-1-(((S)-6-amino-1-(((1S,2R)-1-carboxy-2-hydroxypropyl)amino)-1-oxohexan-2-yl)amino)-4-carboxy-1-oxobutan-2-yl)amino)-3-hydroxy-1-oxobutan-2-yl)carbamoyl)pyrrolidine-1-carbonyl)-21-((S)-2-amino-3-methylbutanamido)-15-benzyl-9-(hydroxymethyl)-12-isobutyl-18-(mercaptomethyl)-8,11,14,17,20-pentaoxo-2,7,10,13,16,19-hexaazatricos-1-en-23-oic acid
IUPAC Name(6S,9S,12S,15S,18R,21S)-1,1-diamino-6-((S)-2-(((2S,3R)-1-(((S)-1-(((S)-6-amino-1-(((1S,2R)-1-carboxy-2-hydroxypropyl)amino)-1-oxohexan-2-yl)amino)-4-carboxy-1-oxobutan-2-yl)amino)-3-hydroxy-1-oxobutan-2-yl)carbamoyl)pyrrolidine-1-carbonyl)-21-((S)-2-amino-3-methylbutanamido)-15-benzyl-9-(hydroxymethyl)-12-isobutyl-18-(mercaptomethyl)-8,11,14,17,20-pentaoxo-2,7,10,13,16,19-hexaazatricos-1-en-23-oic acid
Molecular FormulaC60H98N16O20S
Molecular Weight1395.60
SMILESCC(C)C[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CS)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O
InChI KeyRJEAEIUDNCLZNN-VUZGFOMDSA-N
SynonymPeptide 5;L-Threonine, L-valyl-L-α-aspartyl-L-cysteinyl-L-phenylalanyl-L-leucyl-L-seryl-L-arginyl-L-prolyl-L-threonyl-L-α-glutamyl-L-lysyl-;Peptide 5 trifluoroacetate salt;Connexin43 mimetic peptide 5 trifluoroacetate salt
CAS No.916977-43-0

Synthetic Route by SureRoute

1. ACSYBF137 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACSYBF137 route product structure diagram
    ACSYBF137916977-43-0
Inquiry

2. ACSYBF137 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACSYBF137 route product structure diagram
    ACSYBF137916977-43-0
Inquiry

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