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Substance Name: 4-(N-(Acetoxyethyl)-N-methylamino)-7-nitro-2,1,3-benzoxadiazole ubiquinone
RN: 119110-36-0
InChIKey: OEUJSTITFXGWNB-TUBNFATKSA-N

Molecular Formula

  • C70-H102-N4-O9

Molecular Weight

  • 1143.59
 
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Names and Synonyms

Name of Substance

  • 4-(N-(Acetoxyethyl)-N-methylamino)-7-nitro-2,1,3-benzoxadiazole ubiquinone

Synonym

  • NBDUQ

Systematic Name

  • Acetic acid, (3-(3,7,11,15,19,23,27,31,35,39-decamethyl-2,6,10,14,18,22,26,30,34,38-tetracontadecaenyl)-4-hydroxy-5,6-dimethoxy-2-methylphenoxy)-, 2-(methyl(7-nitro-4-benzofurazanyl)amino)ethyl ester, (all-E)-

Registry Numbers

CAS Registry Number

  • 119110-36-0

System Generated Number

  • 0119110360

Structure Descriptors

InChI

1S/C70H102N4O9/c1-50(2)25-16-26-51(3)27-17-28-52(4)29-18-30-53(5)31-19-32-54(6)33-20-34-55(7)35-21-36-56(8)37-22-38-57(9)39-23-40-58(10)41-24-42-59(11)43-44-61-60(12)68(70(80-15)69(79-14)67(61)76)82-49-64(75)81-48-47-73(13)62-45-46-63(74(77)78)66-65(62)71-83-72-66/h25,27,29,31,33,35,37,39,41,43,45-46,76H,16-24,26,28,30,32,34,36,38,40,42,44,47-49H2,1-15H3/b51-27-,52-29-,53-31-,54-33-,55-35-,56-37-,57-39-,58-41-,59-43-

InChIKey

OEUJSTITFXGWNB-TUBNFATKSA-N

Smiles

C(COc1c(c(c(c(c1OC)OC)O)C\C=C(/CC\C=C(/CC\C=C(/CC\C=C(/CC\C=C(/CC\C=C(/CC\C=C(/CC\C=C(/CC\C=C(/CC\C=C(\C)C)C)C)C)C)C)C)C)C)C)C)(=O)OCCN(c1ccc(c2c1non2)[N+](=O)[O-])C