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Substance Name: Versiconol acetate
RN: 70979-72-5
UNII: K9TGA2Z1WA
InChIKey: BWYUKBCRHDFWFF-SECBINFHSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C20-H18-O9

Molecular Weight

  • 402.3532
 
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Names and Synonyms

Name of Substance

  • Versiconol acetate

Synonyms

  • BRN 2067482
  • UNII-K9TGA2Z1WA
  • Versiconol acetate

Systematic Name

  • 9,10-Anthracenedione, 2-(3-(acetyloxy)-1-(hydroxymethyl)propyl)-1,3,6,8-tetrahydroxy-, (-)-

Registry Numbers

CAS Registry Number

  • 70979-72-5

FDA UNII

  • K9TGA2Z1WA

System Generated Number

  • 0070979725

Structure Descriptors

InChI

1S/C20H18O9/c1-8(22)29-3-2-9(7-21)15-14(25)6-12-17(19(15)27)20(28)16-11(18(12)26)4-10(23)5-13(16)24/h4-6,9,21,23-25,27H,2-3,7H2,1H3/t9-/m1/s1

InChIKey

BWYUKBCRHDFWFF-SECBINFHSA-N

Smiles

CC(=O)OCC[C@H](CO)c1c(O)cc2C(=O)c3cc(O)cc(O)c3C(=O)c2c1O