(1′R,6R,6aR,7R,13S,14S,16R)-8,14-dihydroxy-6′,9-dimethoxy-4,10,23-trimethyl-19-oxo-2′,3′,4′,6,7,9′,12,13,14,16-decahydro-6aH-spiro[7,13-azano-6,16-(epithiopropanooxymethano)[1,3]dioxolo[7,8]isoquinolino[3,2-b][3]benzazocine-20,1′-pyrido[3,4-b]indol]-5-yl acetate

Catalog No. :
ACNJIB388
CAS No. :
497871-47-3
Molecular Formula :
C41H44N4O10S
Molecular Weight :
784.89

IUPAC Name:(1′R,6R,6aR,7R,13S,14S,16R)-8,14-dihydroxy-6′,9-dimethoxy-4,10,23-trimethyl-19-oxo-2′,3′,4′,6,7,9′,12,13,14,16-decahydro-6aH-spiro[7,13-azano-6,16-(epithiopropanooxymethano)[1,3]dioxolo[7,8]isoquinolino[3,2-b][3]benzazocine-20,1′-pyrido[3,4-b]indol]-5-yl acetate

(1′R,6R,6aR,7R,13S,14S,16R)-8,14-dihydroxy-6′,9-dimethoxy-4,10,23-trimethyl-19-oxo-2′,3′,4′,6,7,9′,12,13,14,16-decahydro-6aH-spiro[7,13-azano-6,16-(epithiopropanooxymethano)[1,3]dioxolo[7,8]isoquinolino[3,2-b][3]benzazocine-20,1′-pyrido[3,4-b]indol]-5-yl acetate structure diagram
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Product Information

Product Name(1′R,6R,6aR,7R,13S,14S,16R)-8,14-dihydroxy-6′,9-dimethoxy-4,10,23-trimethyl-19-oxo-2′,3′,4′,6,7,9′,12,13,14,16-decahydro-6aH-spiro[7,13-azano-6,16-(epithiopropanooxymethano)[1,3]dioxolo[7,8]isoquinolino[3,2-b][3]benzazocine-20,1′-pyrido[3,4-b]indol]-5-yl acetate
IUPAC Name(1′R,6R,6aR,7R,13S,14S,16R)-8,14-dihydroxy-6′,9-dimethoxy-4,10,23-trimethyl-19-oxo-2′,3′,4′,6,7,9′,12,13,14,16-decahydro-6aH-spiro[7,13-azano-6,16-(epithiopropanooxymethano)[1,3]dioxolo[7,8]isoquinolino[3,2-b][3]benzazocine-20,1′-pyrido[3,4-b]indol]-5-yl acetate
MDL No.MFCD22665743
Molecular FormulaC41H44N4O10S
Molecular Weight784.89
SMILESO[C@@H]1N2[C@@]([C@@]3([H])C4=C(O)C(OC)=C(C)C=C4C[C@]1([H])N3C)([H])[C@]5([H])C6=C(OC(C)=O)C(C)=C(OCO7)C7=C6[C@@]2([H])COC([C@]8(C9=C(CCN8)C%10=CC(OC)=CC=C%10N9)CS5)=O
InChI KeyYDDMIZRDDREKEP-BQKWZBNDSA-N
SynonymT0321 | DTXCID60120556 | s9603 | LURBINECTEDIN [MI] | Tryptamicidin | PM01183;PM-1183;LY-01017;ryptamicidin | s6294 | EX-A4316 | lurbinectedinum | LURBINECTEDIN [WHO-DD] | 2CN60TN6ZS | GTPL10681 | PM 01183 | Q27254568 | PM1183 | PM-1183 | [(1R,2R,3R,11S,1
CAS No.497871-47-3
PubChem CID57327016

Safety Data

Pictogram
Harmful or irritant
Signal Word
Warning
Hazard Statement(s)
H302-H315-H319-H335
Precautionary Statement(s)
P261-P305+P351+P338

Synthetic Route by SureRoute

1. ACNJIB388 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. ACNJIB388 route product structure diagram
    ACNJIB388497871-47-3
Inquiry

2. ACNJIB388 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACNJIB388 route product structure diagram
    ACNJIB388497871-47-3
Inquiry

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