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Substance Name: Deoxyshikonin
RN: 43043-74-9
UNII: X908DXC99I
InChIKey: VOMDIEGPEURZJO-UHFFFAOYSA-N

Note

  • Isolated from Lithospermum erythrorhizon.

Molecular Formula

  • C16-H16-O4

Molecular Weight

  • 272.2984
 
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Names and Synonyms

Name of Substance

  • Deoxyshikonin

Synonyms

  • Arnebin 7
  • NSC 179184
  • UNII-X908DXC99I

Systematic Name

  • 1,4-Naphthalenedione, 5,8-dihydroxy-2-(4-methyl-3-pentenyl)-

Registry Numbers

CAS Registry Number

  • 43043-74-9

FDA UNII

  • X908DXC99I

System Generated Number

  • 0043043749

Structure Descriptors

InChI

1S/C16H16O4/c1-9(2)4-3-5-10-8-13(19)14-11(17)6-7-12(18)15(14)16(10)20/h4,6-8,17-18H,3,5H2,1-2H3

InChIKey

VOMDIEGPEURZJO-UHFFFAOYSA-N

Smiles

CC(=CCCC1=CC(=O)c2c(ccc(c2C1=O)O)O)C