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Substance Name: Roughanic acid
RN: 7561-64-0
UNII: 3IGF6441ID
InChIKey: KBGYPXOSNDMZRV-PDBXOOCHSA-N

Molecular Formula

  • C16-H26-O2

Molecular Weight

  • 250.3794
 
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Names and Synonyms

Name of Substance

  • Roughanic acid

Synonyms

  • (7Z,10Z,13Z)-7,10,13-Hexadecatrienoic acid
  • (Z,Z,Z)-7,10,13-Hexadecatrienoic acid
  • 7,10,13-Hexadecatrienoic acid, (7Z,10Z,13Z)-
  • All-cis-7,10,13-hexadecatrienoic acid
  • Roughanic acid
  • UNII-3IGF6441ID

Registry Numbers

CAS Registry Number

  • 7561-64-0

FDA UNII

  • 3IGF6441ID

System Generated Number

  • 0007561640

Structure Descriptors

InChI

1S/C16H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h3-4,6-7,9-10H,2,5,8,11-15H2,1H3,(H,17,18)/b4-3-,7-6-,10-9-

InChIKey

KBGYPXOSNDMZRV-PDBXOOCHSA-N

Smiles

CC\C=C/C\C=C/C\C=C/CCCCCC(=O)O