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Substance Name: Mitorubrin
RN: 3403-71-2
UNII: N5I8GAO703
InChIKey: ZLULUXWJVBHEMS-KTBYTZPXSA-N

Molecular Formula

  • C21-H18-O7

Molecular Weight

  • 382.3662
 
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Names and Synonyms

Name of Substance

  • Mitorubrin

Synonyms

  • Mitorubrin
  • UNII-N5I8GAO703

Systematic Name

  • Benzoic acid, 2,4-dihydroxy-6-methyl-, 7,8-dihydro-7-methyl-6,8-dioxo-3-(1-propenyl)-6H-2-benzopyran-7-yl ester, (R-(E))-

Registry Numbers

CAS Registry Number

  • 3403-71-2

FDA UNII

  • N5I8GAO703

System Generated Number

  • 0003403712

Structure Descriptors

InChI

1S/C21H18O7/c1-4-5-14-7-12-8-17(24)21(3,19(25)15(12)10-27-14)28-20(26)18-11(2)6-13(22)9-16(18)23/h4-10,22-23H,1-3H3/b5-4+/t21-/m1/s1

InChIKey

ZLULUXWJVBHEMS-KTBYTZPXSA-N

Smiles

C/C=C/C1=CC2=CC(=O)[C@@](C(=O)C2=CO1)(C)OC(=O)c3c(cc(cc3O)O)C