Chem
J-GLOBAL ID:200907032089246805
Nikkaji number:J1.258.439C
5-[4-(16-Hydroxyhexadecyloxy)phenyl]-2-pyrazinecarboxylic acid
5-[4-(16-ヒドロキシヘキサデシルオキシ)フェニル]-2-ピラジンカルボン酸
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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:
C27 H40 N2 O4
Molecular formula furigana:
C27-H40-N2-O4
Molecular weight:
456.627
InChI:
InChI=1S/C27H40N2O4/c30-19-13-11-9-7-5-3-1-2-4-6-8-10-12-14-20-33-24-17-15-23(16-18-24)25-21-29-26(22-28-25)27(31)32/h15-18,21-22,30H,1-14,19-20H2,(H,31,32)
InChI key:
GEQDDXIYSQNYFG-UHFFFAOYSA-N
SMILES:
OCCCCCCCCCCCCCCCCOc1ccc(cc1)c1cnc(cn1)C(=O)O
Systematic name (3):
5-[4-(16-ヒドロキシヘキサデシルオキシ)フェニル]-2-ピラジンカルボン酸
5-{4-[(16-ヒドロキシヘキサデシル)オキシ]フェニル}ピラジン-2-カルボン酸
5-{4-[(16-hydroxyhexadecyl)oxy]phenyl}pyrazine-2-carboxylic acid
Other name (1):
5-[4-(16-Hydroxyhexadecyloxy)phenyl]-2-pyrazinecarboxylic acid
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