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Substance Name: Abietic acid, glyceryl ester
RN: 1337-89-9
UNII: 2F22LY70Q1
InChIKey: PICABBUEHGURLB-XTICBAGASA-N

Molecular Formula

  • C20-H30-O2.x-C3-H8-O3

Molecular Weight

  • 394.548
 
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Names and Synonyms

Name of Substance

  • Abietic acid, glyceryl ester
  • Glyceryl abietate

Synonym

  • UNII-2F22LY70Q1

Systematic Name

  • 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-, (1R,4aR,4bR,10aR)-, ester with 1,2,3-propanetriol

Registry Numbers

CAS Registry Number

  • 1337-89-9

FDA UNII

  • 2F22LY70Q1

Other Registry Number

  • 70226-25-4

System Generated Number

  • 0001337899

Molecular Formulas

Molecular Formula

  • C20-H30-O2.x-C3-H8-O3

Molecular Formula Fragments

  • C20-H30-O2
  • C3-H8-O3
  • COMPONENT

Structure Descriptors

InChI

1S/C20H30O2.C3H8O3/c1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22;4-1-3(6)2-5/h7,12-13,16-17H,5-6,8-11H2,1-4H3,(H,21,22);3-6H,1-2H2/t16-,17+,19+,20+;/m0./s1

InChIKey

PICABBUEHGURLB-XTICBAGASA-N

Smiles

C1C[C@]([C@H]2[C@@](C1)([C@@H]1C(C=C(C(C)C)CC1)=CC2)C)(C(=O)O)C.OC(CO)CO