Chem
J-GLOBAL ID:200907011481339113   Nikkaji number:J2.127.476C

Butanedioic acid 1-[29-(acetylthio)-3,6,9,12,15,18-hexaoxanonacosane-1-yl] ester

ブタン二酸1-[29-(アセチルチオ)-3,6,9,12,15,18-ヘキサオキサノナコサン-1-イル]
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: C29H54O11S
Molecular formula furigana: C29-H54-O11-S
Molecular weight: 610.800
InChI: InChI=1S/C29H54O11S/c1-27(30)41-26-10-8-6-4-2-3-5-7-9-13-34-14-15-35-16-17-36-18-19-37-20-21-38-22-23-39-24-25-40-29(33)12-11-28(31)32/h2-26H2,1H3,(H,31,32)
InChI key: HLBZWOGPUPCCHD-UHFFFAOYSA-N
SMILES: CC(=O)SCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOC(=O)CCC(=O)O
Systematic name  (3):
  • ブタン二酸1-[29-(アセチルチオ)-3,6,9,12,15,18-ヘキサオキサノナコサン-1-イル]
  • 4-オキソ-4-[(31-オキソ-3,6,9,12,15,18-ヘキサオキサ-30-チアドトリアコンタン-1-イル)オキシ]ブタン酸
  • 4-oxo-4-[(31-oxo-3,6,9,12,15,18-hexaoxa-30-thiadotriacontan-1-yl)oxy]butanoic acid
Other name (1):
  • Butanedioic acid 1-[29-(acetylthio)-3,6,9,12,15,18-hexaoxanonacosane-1-yl] ester
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