Chem
J-GLOBAL ID:200907045576914265   Nikkaji number:J1.995.977E

(5S)-3-[(15S)-15-Hydroxy-15-[(2S,5S)-5-[(1R)-1-hydroxytridecyl]-2-oxolanyl]pentadecyl]-5α-methyl-2(5H)-furanone

(5S)-3-[(15S)-15-ヒドロキシ-15-[(2S,5S)-5-[(1R)-1-ヒドロキシトリデシル]-2-オキソラニル]ペンタデシル]-5α-メチル-2(5H)-フラノン
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: C37H68O5
Molecular formula furigana: C37-H68-O5
Molecular weight: 592.946
InChI: InChI=1S/C37H68O5/c1-3-4-5-6-7-8-14-17-20-23-26-33(38)35-28-29-36(42-35)34(39)27-24-21-18-15-12-10-9-11-13-16-19-22-25-32-30-31(2)41-37(32)40/h30-31,33-36,38-39H,3-29H2,1-2H3/t31-,33+,34-,35-,36-/m0/s1
InChI key: BDGWQMLWIGDEKO-KJBGYCENSA-N
SMILES: CCCCCCCCCCCC[C@@H](O)[C@@H]1CC[C@H](O1)[C@@H](O)CCCCCCCCCCCCCCC1=C[C@H](C)OC1=O
Systematic name  (5):
  • (2S)-2α-[(R)-1-ヒドロキシトリデシル]-5β-[(S)-1-ヒドロキシ-15-[(5S)-2-オキソ-5α-メチル-2,5-ジヒドロフラン-3-イル]ペンタデシル]テトラヒドロフラン
  • (5S)-3-[(15S)-15-ヒドロキシ-15-[(2S,5S)-5-[(1R)-1-ヒドロキシトリデシル]テトラヒドロフラン-2-イル]ペンタデシル]-5-メチルフラン-2(5H)-オン
  • (5S)-3-[(15S)-15-ヒドロキシ-15-[(2S,5S)-5-[(1R)-1-ヒドロキシトリデシル]-2-オキソラニル]ペンタデシル]-5α-メチル-2(5H)-フラノン
  • (5S)-3-[(15S)-15-ヒドロキシ-15-[(2S,5S)-5-[(1R)-1-ヒドロキシトリデシル]オキソラン-2-イル]ペンタデシル]-5-メチル-2,5-ジヒドロフラン-2-オン
  • (5S)-3-[(15S)-15-hydroxy-15-[(2S,5S)-5-[(1R)-1-hydroxytridecyl]oxolan-2-yl]pentadecyl]-5-methyl-2,5-dihydrofuran-2-one
Other name (3):
  • (2S)-2α-[(R)-1-Hydroxytridecyl]-5β-[(S)-1-hydroxy-15-[(5S)-2-oxo-5α-methyl-2,5-dihydrofuran-3-yl]pentadecyl]tetrahydrofuran
  • (5S)-3-[(15S)-15-Hydroxy-15-[(2S,5S)-5-[(1R)-1-hydroxytridecyl]tetrahydrofuran-2-yl]pentadecyl]-5-methylfuran-2(5H)-one
  • (5S)-3-[(15S)-15-Hydroxy-15-[(2S,5S)-5-[(1R)-1-hydroxytridecyl]-2-oxolanyl]pentadecyl]-5α-methyl-2(5H)-furanone
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