Granaticin

CAS Registry Number®

19879-06-2
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CAS Name

Granaticin

Molecular Formula

C22H20O10

Molecular Mass

444.39

Cite this Page

Granaticin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=19879-06-2 (retrieved 2024-05-02) (CAS RN: 19879-06-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H20O10/c1-5-11-15(21-8(30-5)4-10(24)32-21)19(27)13-14(17(11)25)20(28)16-12(18(13)26)7-3-9(23)22(16,29)6(2)31-7/h5-9,21,23,26,28-29H,3-4H2,1-2H3/t5-,6+,7+,8-,9+,21+,22+/m0/s1

InChIKey

InChIKey=QBQXQYSJPWXZJL-LHKCJDRRSA-N

SMILES

O[C@@]12C=3C([C@@](C[C@H]1O)(O[C@@H]2C)[H])=C(O)C4=C(C3O)C(=O)C5=C(C4=O)[C@]6([C@@](O[C@H]5C)(CC(=O)O6)[H])[H]

Canonical SMILES

O=C1C=2C(O)=C3C(=C(O)C2C(=O)C4=C1C(OC5CC(=O)OC45)C)C6OC(C)C3(O)C(O)C6

Other Names for this Substance

  • 8,11-Ethanofuro[2,3-e]naphtho[2,3-c:6,7-c′]dipyran-2,6,13(9H)-trione, 3,3a,5,8,11,13b-hexahydro-7,8,12,15-tetrahydroxy-5,9-dimethyl-, (3aS,5S,8S,9R,11R,13bS,15R)-
  • Granaticin
  • 8,11-Ethanofuro[2,3-e]naphtho[2,3-c:6,7-c′]dipyran-2,6,13(9H)-trione, 3,3a,5,8,11,13b-hexahydro-7,8,12,15-tetrahydroxy-5,9-dimethyl-, [3aS-(3aα,5α,8α,9α,11β,13bα,15S*)]-
  • (3aS,5S,8S,9R,11R,13bS,15R)-3,3a,5,8,11,13b-Hexahydro-7,8,12,15-tetrahydroxy-5,9-dimethyl-8,11-ethanofuro[2,3-e]naphtho[2,3-c:6,7-c′]dipyran-2,6,13(9H)-trione
  • Antibiotic WR 141

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Deleted or Replaced CAS Registry Numbers

1399-56-0, 25895-12-9, 79104-65-7

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