Chem
J-GLOBAL ID:200907011484954552
Nikkaji number:J2.584.248K
3-[4-(Isopentyloxy)phenyl]-7-(hexadecyloxy)-4H-1-benzopyran-4-one
7-(ヘキサデシルオキシ)-3-[4-(3-メチルブトキシ)フェニル]-4H-クロメン-4-オン
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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:
C36 H52 O4
Molecular formula furigana:
C36-H52-O4
Molecular weight:
548.808
InChI:
InChI=1S/C36H52O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25-38-32-22-23-33-35(27-32)40-28-34(36(33)37)30-18-20-31(21-19-30)39-26-24-29(2)3/h18-23,27-29H,4-17,24-26H2,1-3H3
InChI key:
TYHCEEMNJPIQIZ-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCOc1ccc2c(c1)occ(c1ccc(OCCC(C)C)cc1)c2=O
Systematic name (4):
3-[4-(イソペンチルオキシ)フェニル]-7-(ヘキサデシルオキシ)-4H-1-ベンゾピラン-4-オン
3-[4-(3-メチルブトキシ)フェニル]-7-(ヘキサデシルオキシ)-4H-1-ベンゾピラン-4-オン
7-(ヘキサデシルオキシ)-3-[4-(3-メチルブトキシ)フェニル]-4H-クロメン-4-オン
7-(hexadecyloxy)-3-[4-(3-methylbutoxy)phenyl]-4H-chromen-4-one
Other name (2):
3-[4-(Isopentyloxy)phenyl]-7-(hexadecyloxy)-4H-1-benzopyran-4-one
3-[4-(3-Methylbutoxy)phenyl]-7-(hexadecyloxy)-4H-1-benzopyran-4-one
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