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Substance Name: Pododacric acid
RN: 32630-75-4
UNII: BP3MU3VH64
InChIKey: DARXGOKMAVGSTE-RLLQIKCJSA-N

Molecular Formula

  • C20-H28-O5

Molecular Weight

  • 348.4362
 
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Names and Synonyms

Name of Substance

  • Pododacric acid

Synonyms

  • 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,9,10,10a-octahydro-6-hydroxy-7-(2-hydroxy-1-(hydroxymethyl)ethyl)-1,4a-dimethyl-, (1S,4aS,10aR)-
  • Pododacric acid
  • Pododacric acid [MI]
  • UNII-BP3MU3VH64

Registry Numbers

CAS Registry Number

  • 32630-75-4

FDA UNII

  • BP3MU3VH64

System Generated Number

  • 0032630754

Structure Descriptors

InChI

1S/C20H28O5/c1-19-6-3-7-20(2,18(24)25)17(19)5-4-12-8-14(13(10-21)11-22)16(23)9-15(12)19/h8-9,13,17,21-23H,3-7,10-11H2,1-2H3,(H,24,25)/t17-,19-,20+/m1/s1

InChIKey

DARXGOKMAVGSTE-RLLQIKCJSA-N

Smiles

C[C@]12CCC[C@]([C@@H]1CCc3c2cc(c(c3)C(CO)CO)O)(C)C(=O)O