Nidurufin

CAS Registry Number®

28458-23-3
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CAS Name

Nidurufin

Molecular Formula

C20H16O8

Molecular Mass

384.34

Cite this Page

Nidurufin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=28458-23-3 (retrieved 2024-05-21) (CAS RN: 28458-23-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    203-206 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C20H16O8/c1-20-3-2-10(22)19(28-20)15-12(27-20)6-9-14(18(15)26)17(25)13-8(16(9)24)4-7(21)5-11(13)23/h4-6,10,19,21-23,26H,2-3H2,1H3/t10-,19-,20+/m0/s1

InChIKey

InChIKey=JJXUKZWOMSARJK-UUADDVKTSA-N

SMILES

OC1=C2C(=CC3=C1C(=O)C=4C(C3=O)=CC(O)=CC4O)O[C@]5(C)O[C@]2([C@@H](O)CC5)[H]

Canonical SMILES

O=C1C=2C=C(O)C=C(O)C2C(=O)C3=C(O)C4=C(OC5(OC4C(O)CC5)C)C=C13

Other Names for this Substance

  • 2,6-Epoxy-2H-anthra[2,3-b]oxocin-8,13-dione, 3,4,5,6-tetrahydro-5,7,9,11-tetrahydroxy-2-methyl-, (2S,5S,6R)-
  • 2,6-Epoxy-2H-anthra[2,3-b]oxocin-8,13-dione, 3,4,5,6-tetrahydro-5,7,9,11-tetrahydroxy-2-methyl-, [2S-(2α,5α,6α)]-
  • (2S,5S,6R)-3,4,5,6-Tetrahydro-5,7,9,11-tetrahydroxy-2-methyl-2,6-epoxy-2H-anthra[2,3-b]oxocin-8,13-dione
  • Nidurufin

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