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Substance Name: Macrocarpal J
RN: 179603-47-5
InChIKey: PXQFFMATXFLUPK-HMVMQGJUSA-N

Note

  • Formylated phloroglucinol from Eucalyptus globulus.

Molecular Formula

  • C28-H42-O7

Molecular Weight

  • 490.633
 
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Names and Synonyms

Results Name

  • Macrocarpal J

Synonym

  • Macrocarpal J

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 179603-47-5

Other Registry Number

  • 194727-32-7

System Generated Number

  • 0179603475

Structure Descriptors

InChI

1S/C28H42O7/c1-15(2)11-17(22-24(32)18(13-29)23(31)19(14-30)25(22)33)20-8-10-28(6,35)21-12-16(26(3,4)34)7-9-27(20,21)5/h13-17,20-21,31-35H,7-12H2,1-6H3/t16?,17-,20?,21?,27?,28-/m0/s1

InChIKey

PXQFFMATXFLUPK-HMVMQGJUSA-N

Smiles

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