SDOX

Catalog No. :
ACERUO998
CAS No. :
2921601-78-5
Molecular Formula :
C69H97NO20S2
Molecular Weight :
1324.66

IUPAC Name:2-(2-(2-(((3R,10R,13R,17R)-10,13-dimethyl-17-((R)-6-methylheptan-2-yl)-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl)oxy)ethoxy)ethoxy)ethyl (2-((2-((((2S,3S,4S,6S)-3-hydroxy-2-methyl-6-(((1S,3S)-3,5,12-trihydroxy-3-(2-hydroxyacetyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl)oxy)tetrahydro-2H-pyran-4-yl)carbamoyl)oxy)ethyl)disulfaneyl)ethyl) succinate

SDOX structure diagram
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Product Information

Product NameSDOX
IUPAC Name2-(2-(2-(((3R,10R,13R,17R)-10,13-dimethyl-17-((R)-6-methylheptan-2-yl)-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl)oxy)ethoxy)ethoxy)ethyl (2-((2-((((2S,3S,4S,6S)-3-hydroxy-2-methyl-6-(((1S,3S)-3,5,12-trihydroxy-3-(2-hydroxyacetyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl)oxy)tetrahydro-2H-pyran-4-yl)carbamoyl)oxy)ethyl)disulfaneyl)ethyl) succinate
Molecular FormulaC69H97NO20S2
Molecular Weight1324.66
SMILESCOC1=C(C(C(C(O)=C([C@@H](O[C@H]2O[C@@H](C)[C@@H](O)[C@@H](NC(OCCSSCCOC(CCC(OCCOCCOCCO[C@H]3CC4=CCC(C(CC[C@@H]5[C@H](C)CCCC(C)C)[C@]5(C)CC6)C6[C@@]4(C)CC3)=O)=O)=O)C2)C[C@@](C(CO)=O)(O)C7)C7=C8O)=C8C9=O)=O)C9=CC=C1
InChI KeyQPBKORWGSBLEPU-PBAOEZERSA-N
SynonymSDOX;5,12-Naphthacenedione, 10-[[3-[[22-[(3β)-cholest-5-en-3-yloxy]-1,10,13-trioxo-2,9,14,17,20-pentaoxa-5,6-dithiadocas-1-yl]amino]-2,3,6-trideoxy-α-L-lyxo-hexopyranosyl]oxy]-7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(2-hydroxyacetyl)-1-methoxy-, (8S,10S)-
CAS No.2921601-78-5

Synthetic Route by SureRoute

1. ACERUO998 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. ACERUO998 route product structure diagram
    ACERUO9982921601-78-5
Inquiry

2. ACERUO998 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. ACERUO998 route product structure diagram
    ACERUO9982921601-78-5
Inquiry

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