12-((3S,4S)-1-(4-((3S,4S)-3,4-bis(((1S,2R)-2-Phenylcyclopropyl)carbamoyl)pyrrolidine-1-carbonyl)benzoyl)-4-(((1S,2R)-2-phenylcyclopropyl)carbamoyl)pyrrolidine-3-carboxamido)dodecyl (tert-butoxycarbonyl)glycinate

Catalog No. :
ACXMBA967
CAS No. :
3005274-77-8
Molecular Formula :
C66H83N7O10
Molecular Weight :
1134.43

IUPAC Name:12-((3S,4S)-1-(4-((3S,4S)-3,4-bis(((1S,2R)-2-phenylcyclopropyl)carbamoyl)pyrrolidine-1-carbonyl)benzoyl)-4-(((1S,2R)-2-phenylcyclopropyl)carbamoyl)pyrrolidine-3-carboxamido)dodecyl (tert-butoxycarbonyl)glycinate

12-((3S,4S)-1-(4-((3S,4S)-3,4-bis(((1S,2R)-2-Phenylcyclopropyl)carbamoyl)pyrrolidine-1-carbonyl)benzoyl)-4-(((1S,2R)-2-phenylcyclopropyl)carbamoyl)pyrrolidine-3-carboxamido)dodecyl (tert-butoxycarbonyl)glycinate structure diagram
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Product Information

Product Name12-((3S,4S)-1-(4-((3S,4S)-3,4-bis(((1S,2R)-2-Phenylcyclopropyl)carbamoyl)pyrrolidine-1-carbonyl)benzoyl)-4-(((1S,2R)-2-phenylcyclopropyl)carbamoyl)pyrrolidine-3-carboxamido)dodecyl (tert-butoxycarbonyl)glycinate
IUPAC Name12-((3S,4S)-1-(4-((3S,4S)-3,4-bis(((1S,2R)-2-phenylcyclopropyl)carbamoyl)pyrrolidine-1-carbonyl)benzoyl)-4-(((1S,2R)-2-phenylcyclopropyl)carbamoyl)pyrrolidine-3-carboxamido)dodecyl (tert-butoxycarbonyl)glycinate
Molecular FormulaC66H83N7O10
Molecular Weight1134.43
SMILESCC(OC(NCC(OCCCCCCCCCCCCNC([C@@H]1CN(C(C2=CC=C(C(N3C[C@@H](C(N[C@@H]4[C@H](C4)C5=CC=CC=C5)=O)[C@H](C(N[C@H]6C[C@@H]6C7=CC=CC=C7)=O)C3)=O)C=C2)=O)C[C@H]1C(N[C@H]8C[C@@H]8C9=CC=CC=C9)=O)=O)=O)=O)(C)C
InChI KeyKEKGLXKWMYJTES-YKAPJTMCSA-N
SynonymDiprovocim-X;Glycine, N-[(1,1-dimethylethoxy)carbonyl]-, 12-[[[(3S,4S)-1-[4-[[(3S,4S)-3,4-bis[[[(1S,2R)-2-phenylcyclopropyl]amino]carbonyl]-1-pyrrolidinyl]carbonyl]benzoyl]-4-[[[(1S,2R)-2-phenylcyclopropyl]amino]carbonyl]-3-pyrrolidinyl]carbonyl]amino]dodecyl ester
CAS No.3005274-77-8

Synthetic Route by SureRoute

1. ACXMBA967 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
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  2. Plus
  3. reactant_2 route compound structure diagram
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  4. Then
  5. ACXMBA967 route product structure diagram
    ACXMBA9673005274-77-8
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2. ACXMBA967 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACXMBA967 route product structure diagram
    ACXMBA9673005274-77-8
Inquiry

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