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Substance Name: Macrocarpal H
RN: 179388-53-5
InChIKey: OOAOETHJYYAVCC-XWWMBYKISA-N

Note

  • Formylated phloroglucinol from Eucalyptus globulus.

Molecular Formula

  • C28-H40-O6

Molecular Weight

  • 472.618
 
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Names and Synonyms

Results Name

  • Macrocarpal H

Synonym

  • Macrocarpal H

Systematic Names

  • 1,3-Benzenedicarboxaldehyde, 5-((1S)-1-((1S,4aS,6R,8aS)-decahydro-6-(1-hydroxy-1-methylethyl)-8a-methyl-4-methylene-1-naphthalenyl)-3-methylbutyl)-2,4,6-trihydroxy-
  • 1,3-Benzenedicarboxaldehyde, 5-(1-(decahydro-6-(1-hydroxy-1-methylethyl)-8a-methyl-4-methylene-1-naphthalenyl)-3-methylbutyl)-2,4,6-trihydroxy-, (1S-(1alpha(R*),4abeta,6alpha,8aalpha))-

Registry Numbers

CAS Registry Number

  • 179388-53-5

Other Registry Number

  • 194727-30-5

System Generated Number

  • 0179388535

Structure Descriptors

InChI

1S/C28H40O6/c1-15(2)11-18(23-25(32)19(13-29)24(31)20(14-30)26(23)33)21-8-7-16(3)22-12-17(27(4,5)34)9-10-28(21,22)6/h13-15,17-18,21-22,31-34H,3,7-12H2,1-2,4-6H3/t17-,18?,21+,22+,28+/m1/s1

InChIKey

OOAOETHJYYAVCC-XWWMBYKISA-N

Smiles

c1(c(c(c(c(c1O)[C@@H](CC(C)C)[C@@H]1CCC([C@@H]2C[C@@H](CC[C@@]12C)C(C)(C)O)=C)O)C=O)O)C=O