(5S,6R,7S)-5,6,7,8-Tetrahydro-5,6,7,9,10-pentahydroxy-2-methoxy-7-methyl-1,4-anthracenedione

CAS Registry Number®

21879-81-2

CAS Name

(5S,6R,7S)-5,6,7,8-Tetrahydro-5,6,7,9,10-pentahydroxy-2-methoxy-7-methyl-1,4-anthracenedione

Molecular Formula

C16H16O8

Molecular Mass

336.29

Cite this Page

(5S,6R,7S)-5,6,7,8-Tetrahydro-5,6,7,9,10-pentahydroxy-2-methoxy-7-methyl-1,4-anthracenedione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=21879-81-2 (retrieved 2024-11-24) (CAS RN: 21879-81-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    222-224 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H16O8/c1-16(23)4-5-8(14(21)15(16)22)13(20)9-6(17)3-7(24-2)12(19)10(9)11(5)18/h3,14-15,18,20-23H,4H2,1-2H3/t14-,15+,16-/m0/s1

InChIKey

InChIKey=ZQNOLGRKZRDRQO-XHSDSOJGSA-N

SMILES

OC1=C2C(=C(O)C3=C1C(=O)C=C(OC)C3=O)C[C@](C)(O)[C@H](O)[C@H]2O

Canonical SMILES

O=C1C=C(OC)C(=O)C=2C(O)=C3C(=C(O)C12)C(O)C(O)C(O)(C)C3

Other Names for this Substance

  • 1,4-Anthracenedione, 5,6,7,8-tetrahydro-5,6,7,9,10-pentahydroxy-2-methoxy-7-methyl-, (5S,6R,7S)-
  • Anthraquinone, 1,2,3,4-tetrahydro-1β,2β,3β,5,8-pentahydroxy-6-methoxy-3-methyl-
  • 1,4-Anthracenedione, 5,6,7,8-tetrahydro-5,6,7,9,10-pentahydroxy-2-methoxy-7-methyl-, [5S-(5α,6β,7β)]-
  • (5S,6R,7S)-5,6,7,8-Tetrahydro-5,6,7,9,10-pentahydroxy-2-methoxy-7-methyl-1,4-anthracenedione
  • Bostrycin

View All