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Substance Name: Phytosphingosine PCA
RN: 291520-27-9
UNII: 8SPM8ANN58
InChIKey: CMYDLTSVAJKTPU-RXQQAGQTSA-N

Molecular Formula

  • C18-H39-N-O3.C5-H7-N-O3

Molecular Weight

  • 446.6244
 
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Names and Synonyms

Name of Substance

  • Phytosphingosine PCA

Synonyms

  • 1,3,4-Octadecanetriol, 2-amino-, (2S,3S,4R)-, compd. with 5-oxoproline (1:1)
  • Phytosphingosine PCA
  • Phytosphingosine PCA [INCI]
  • Proline, 5-oxo-, compd. with (2S,3S,4R)-2-amino-1,3,4-octadecanetriol (1:1)
  • UNII-8SPM8ANN58

Registry Numbers

CAS Registry Number

  • 291520-27-9

FDA UNII

  • 8SPM8ANN58

System Generated Number

  • 0291520279

Structure Descriptors

InChI

1S/C18H39NO3.C5H7NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(21)18(22)16(19)15-20;7-4-2-1-3(6-4)5(8)9/h16-18,20-22H,2-15,19H2,1H3;3H,1-2H2,(H,6,7)(H,8,9)/t16-,17+,18-;/m0./s1

InChIKey

CMYDLTSVAJKTPU-RXQQAGQTSA-N

Smiles

CCCCCCCCCCCCCC[C@H]([C@H]([C@H](CO)N)O)O.C1CC(=O)NC1C(=O)O