Caffeic acid-pYEEIE

Catalog No. :
ACMXOI076
CAS No. :
507471-72-9
Molecular Formula :
C39H50N5O19P
Molecular Weight :
923.82

IUPAC Name:((2S)-2-((S)-4-carboxy-2-((S)-4-carboxy-2-((S)-2-((E)-3-(3,4-dihydroxyphenyl)acrylamido)-3-(4-(phosphonooxy)phenyl)propanamido)butanamido)butanamido)-3-methylpentanoyl)-L-glutamic acid

Caffeic acid-pYEEIE structure diagram
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Product Information

Product NameCaffeic acid-pYEEIE
IUPAC Name((2S)-2-((S)-4-carboxy-2-((S)-4-carboxy-2-((S)-2-((E)-3-(3,4-dihydroxyphenyl)acrylamido)-3-(4-(phosphonooxy)phenyl)propanamido)butanamido)butanamido)-3-methylpentanoyl)-L-glutamic acid
MDL No.MFCD06798314
Molecular FormulaC39H50N5O19P
Molecular Weight923.82
SMILESCCC(C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC1=CC=C(OP(=O)(O)O)C=C1)NC(=O)/C=C/C1=CC=C(O)C(O)=C1)C(=O)N[C@@H](CCC(=O)O)C(=O)O
InChI KeyOLKLXQPYJYPETQ-GYHHIBSGSA-N
SynonymCAFFEIC ACID-PYEEIE;N-[3-(3,4-Dihydroxyphenyl)-1-oxo-2-propenyl]-O-phosphono-L-tyrosyl-L-a-glutamyl-L-a-glutamyl-L-isoleucyl-L-glutamicacid;N-[3-(3,4-Dihydroxyphenyl)-1-oxo-2-propenyl]-O-phosphono-L-tyrosyl-L-α-glutamyl-L-α-glutamyl-L-isoleucyl-L-glutamicacid;N-[3-(3,4-DIHYDROXYPHENYL)-1-OXO-2-PROPENYL]-O-PHOSPHONO-L-TYROSYL-L-ALPHA-GLUTAMYL-L-ALPHA-GLUTAMYL-L-ISOLEUCYL-L-GLUTAMIC ACID;L-Glutamic acid, N-[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]-O-phosphono-L-tyrosyl-L-α-glutamyl-L-α-glutamyl-L-isoleucyl- (9CI)
CAS No.507471-72-9

Synthetic Route by SureRoute

1. ACMXOI076 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACMXOI076 route product structure diagram
    ACMXOI076507471-72-9
Inquiry

2. ACMXOI076 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACMXOI076 route product structure diagram
    ACMXOI076507471-72-9
Inquiry

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