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Substance Name: 14-Deoxy-11,12-dehydroandrographolide
RN: 42895-58-9
UNII: 5S0X4YZJ0E
InChIKey: XMJAJFVLHDIEHF-CRBRZBHVSA-N

Note

  • A diterpenoid from Andrographis paniculata.

Molecular Formula

  • C20-H28-O4

Molecular Weight

  • 332.4372
 
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Names and Synonyms

Name of Substance

  • 14-Deoxy-11,12-dehydroandrographolide

Synonyms

  • 11,12-Didehydro-14-deoxyandrographolide
  • 14-Deoxy-11,12-dehydroandrographolide
  • 14-Deoxy-11,12-didehydroandrographolide
  • 2(5H)-Furanone, 3-((1E)-2-((1R,4aS,5R,6R,8aR)-decahydro-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylene-1-naphthalenyl)ethenyl)-
  • AP-10
  • UNII-5S0X4YZJ0E

Registry Numbers

CAS Registry Number

  • 42895-58-9

FDA UNII

  • 5S0X4YZJ0E

System Generated Number

  • 0042895589

Structure Descriptors

InChI

1S/C20H28O4/c1-13-4-7-16-19(2,10-8-17(22)20(16,3)12-21)15(13)6-5-14-9-11-24-18(14)23/h5-6,9,15-17,21-22H,1,4,7-8,10-12H2,2-3H3/b6-5+/t15-,16+,17-,19+,20+/m1/s1

InChIKey

XMJAJFVLHDIEHF-CRBRZBHVSA-N

Smiles

C[C@@]12CC[C@H]([C@@]([C@H]1CCC(=C)[C@H]2/C=C/C3=CCOC3=O)(C)CO)O