Acetylshikonin

CAS Registry Number®

24502-78-1
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CAS Name

Acetylshikonin

Molecular Formula

C18H18O6

Molecular Mass

330.33

Cite this Page

Acetylshikonin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=24502-78-1 (retrieved 2024-09-07) (CAS RN: 24502-78-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C18H18O6/c1-9(2)4-7-15(24-10(3)19)11-8-14(22)16-12(20)5-6-13(21)17(16)18(11)23/h4-6,8,15,20-21H,7H2,1-3H3/t15-/m1/s1

InChIKey

InChIKey=WNFXUXZJJKTDOZ-OAHLLOKOSA-N

SMILES

O=C1C=2C(C(=O)C=C1[C@@H](CC=C(C)C)OC(C)=O)=C(O)C=CC2O

Canonical SMILES

O=C1C=C(C(=O)C=2C(O)=CC=C(O)C12)C(OC(=O)C)CC=C(C)C

Other Names for this Substance

  • 1,4-Naphthalenedione, 2-[(1R)-1-(acetyloxy)-4-methyl-3-penten-1-yl]-5,8-dihydroxy-
  • 1,4-Naphthoquinone, 5,8-dihydroxy-2-(1-hydroxy-4-methyl-3-pentenyl)-, 2-acetate, (+)-
  • 1,4-Naphthalenedione, 2-[1-(acetyloxy)-4-methyl-3-pentenyl]-5,8-dihydroxy-, (R)-
  • 1,4-Naphthalenedione, 2-[(1R)-1-(acetyloxy)-4-methyl-3-pentenyl]-5,8-dihydroxy-
  • 2-[(1R)-1-(Acetyloxy)-4-methyl-3-penten-1-yl]-5,8-dihydroxy-1,4-naphthalenedione

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