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Substance Name: Demethylmenaquinone
RN: 29790-47-4
InChIKey: GDUBPWSFXUAETN-AENDIINCSA-N

Molecular Formula

  • C50-H70-O2

Molecular Weight

  • 703.101
 
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Names and Synonyms

Name of Substance

  • Demethylmenaquinone

Systematic Name

  • 1,4-Naphthalenedione, 2-(3,7,11,15,19,23,27,31-octamethyl-2,6,10,14,18,22,26,30-dotriacontaoctaenyl)-, (all-E)-

Registry Numbers

CAS Registry Number

  • 29790-47-4

System Generated Number

  • 0029790474

Structure Descriptors

InChI

1S/C50H70O2/c1-38(2)19-12-20-39(3)21-13-22-40(4)23-14-24-41(5)25-15-26-42(6)27-16-28-43(7)29-17-30-44(8)31-18-32-45(9)35-36-46-37-49(51)47-33-10-11-34-48(47)50(46)52/h10-11,19,21,23,25,27,29,31,33-35,37H,12-18,20,22,24,26,28,30,32,36H2,1-9H3/b39-21+,40-23+,41-25+,42-27+,43-29+,44-31+,45-35+

InChIKey

GDUBPWSFXUAETN-AENDIINCSA-N

Smiles

C1(C(=CC(c2ccccc12)=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(\C)C)C)C)C)C)C)C)C)=O