Chem
J-GLOBAL ID：200907001430200921   Nikkaji number：J186.566H

Pantothenyl ethyl ether

パントテニルエチルエーテル
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C11H23NO4
Molecular formula furigana： C11-H23-N-O4
Molecular weight： 233.308
InChI： InChI=1S/C11H23NO4/c1-4-16-7-5-6-12-10(15)9(14)11(2,3)8-13/h9,13-14H,4-8H2,1-3H3,(H,12,15)/t9-/m0/s1
InChI key： MRAMPOPITCOOIN-VIFPVBQESA-N
SMILES： CCOCCCNC(=O)[C@H](O)C(C)(C)CO
Systematic name  (3)：
  • (2R)-N-(3-エトキシプロピル)-2,4-ジヒドロキシ-3,3-ジメチルブタンアミド
  • (R)-N-(3-エトキシプロピル)-2,4-ジヒドロキシ-3,3-ジメチルブタンアミド
  • (2R)-N-(3-ethoxypropyl)-2,4-dihydroxy-3,3-dimethylbutanamide
Other name (4)：
  • パントテニルエチルエーテル
  • Pantothenyl ethyl ether
  • (2R)-N-(3-Ethoxypropyl)-2,4-dihydroxy-3,3-dimethylbutanamide
  • (R)-N-(3-Ethoxypropyl)-2,4-dihydroxy-3,3-dimethylbutanamide
CAS registry number： 667-83-4
Regulation number (2)：
  • (9)-996
  • EINECS2115691
KEGG DRUG： D01694
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