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Substance Name: Fosmetpantotenate [USAN]
RN: 1858268-66-2
UNII: VA101M0K2F
InChIKey: HUWUHKIPYXWUPN-YVRVQSMLSA-N

Classification Code

  • Treatment of Pantothenate Kinase Associated Neurodegeneration (PKAN)

Molecular Formula

  • C20-H31-N2-O9-S

Molecular Weight

  • 474.4439
 
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Names and Synonyms

Name of Substance

  • Fosmetpantotenate [USAN]

Synonyms

  • Dimethyl 8-hydroxy-2,7,7-trimethyl-4,9-dioxo-4-phenoxy-5-oxa-3,10-diaza-4-lambda5-phosphatridecanedioate, mixture of (2S,4R,8R) and (2S,4S,8R) epimers
  • Fosmetpantotenate
  • RE-024
  • UNII-VA101M0K2F

Systematic Name

  • 5-Oxa-3,10-diaza-4-phosphatridecanedioic acid, 8-hydroxy-2,7,7-trimethyl-9-oxo-4-phenoxy-, 1,13-dimethyl ester, 4-oxide, (2S,8R)-

Registry Numbers

CAS Registry Number

  • 1858268-66-2

FDA UNII

  • VA101M0K2F

System Generated Number

  • 1858268662

Structure Descriptors

InChI

1S/C20H31N2O9P/c1-14(19(26)29-5)22-32(27,31-15-9-7-6-8-10-15)30-13-20(2,3)17(24)18(25)21-12-11-16(23)28-4/h6-10,14,17,24H,11-13H2,1-5H3,(H,21,25)(H,22,27)/t14-,17-,32?/m0/s1

InChIKey

HUWUHKIPYXWUPN-YVRVQSMLSA-N

Smiles

COC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)(N[C@@H](C)C(=O)OC)Oc1ccccc1