Methyl (6aR,7S,10aR)-6,6a,7,10,10a,11-hexahydro-6a,7,10a,12-tetrahydroxy-3,8-dimethoxy-1-methyl-6,10,11-trioxo-2-naphthacenecarboxylate

CAS Registry Number®

71135-22-3
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CAS Name

Methyl (6aR,7S,10aR)-6,6a,7,10,10a,11-hexahydro-6a,7,10a,12-tetrahydroxy-3,8-dimethoxy-1-methyl-6,10,11-trioxo-2-naphthacenecarboxylate

Molecular Formula

C23H20O11

Molecular Mass

472.40

Cite this Page

Methyl (6aR,7S,10aR)-6,6a,7,10,10a,11-hexahydro-6a,7,10a,12-tetrahydroxy-3,8-dimethoxy-1-methyl-6,10,11-trioxo-2-naphthacenecarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=71135-22-3 (retrieved 2024-03-04) (CAS RN: 71135-22-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C23H20O11/c1-8-14-9(6-11(32-2)15(8)21(29)34-4)5-10-16(17(14)25)20(28)22(30)13(24)7-12(33-3)19(27)23(22,31)18(10)26/h5-7,19,25,27,30-31H,1-4H3/t19-,22-,23-/m1/s1

InChIKey

InChIKey=ULHJWHCSSAEMLW-UEVCKROQSA-N

SMILES

O=C1C=2C(C(=O)[C@@]3(O)[C@]1(O)[C@H](O)C(OC)=CC3=O)=C(O)C=4C(C2)=CC(OC)=C(C(OC)=O)C4C

Canonical SMILES

O=C(OC)C1=C(OC)C=C2C=C3C(=O)C4(O)C(O)C(OC)=CC(=O)C4(O)C(=O)C3=C(O)C2=C1C

Other Names for this Substance

  • 2-Naphthacenecarboxylic acid, 6,6a,7,10,10a,11-hexahydro-6a,7,10a,12-tetrahydroxy-3,8-dimethoxy-1-methyl-6,10,11-trioxo-, methyl ester, (6aR,7S,10aR)-
  • 2-Naphthacenecarboxylic acid, 6,6a,7,10,10a,11-hexahydro-6a,7,10a,12-tetrahydroxy-3,8-dimethoxy-1-methyl-6,10,11-trioxo-, methyl ester, [6aR-(6aα,7α,10aα)]-
  • Methyl (6aR,7S,10aR)-6,6a,7,10,10a,11-hexahydro-6a,7,10a,12-tetrahydroxy-3,8-dimethoxy-1-methyl-6,10,11-trioxo-2-naphthacenecarboxylate
  • Tetracenomycin C

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