Chem
J-GLOBAL ID:200907065641185226
Nikkaji number:J723.411B
3-[(13S)-13-[[(2S,5S)-5-[(R)-1-Hydroxytridecyl]tetrahydrofuran]-2-yl]-2,8,13-trihydroxytridecyl]-5-methylfuran-2(5H)-one
3-[(13S)-13-[[(2S,5S)-5-[(R)-1-ヒドロキシトリデシル]テトラヒドロフラン]-2-イル]-2,8,13-トリヒドロキシトリデシル]-5-メチルフラン-2(5H)-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:
C35 H64 O7
Molecular formula furigana:
C35-H64-O7
Molecular weight:
596.890
InChI:
InChI=1S/C35H64O7/c1-3-4-5-6-7-8-9-10-11-15-21-31(38)33-23-24-34(42-33)32(39)22-17-16-19-29(36)18-13-12-14-20-30(37)26-28-25-27(2)41-35(28)40/h25,27,29-34,36-39H,3-24,26H2,1-2H3/t27?,29?,30?,31-,32+,33+,34+/m1/s1
InChI key:
XNODZYPOIPVPRF-FLTFJQSJSA-N
SMILES:
CCCCCCCCCCCC[C@@H](O)[C@@H]1CC[C@H](O1)[C@@H](O)CCCCC(O)CCCCCC(O)CC1=CC(C)OC1=O
Systematic name (3):
3-[(13S)-13-[[(2S,5S)-5-[(R)-1-ヒドロキシトリデシル]テトラヒドロフラン]-2-イル]-2,8,13-トリヒドロキシトリデシル]-5-メチルフラン-2(5H)-オン
5-メチル-3-[(13S)-2,8,13-トリヒドロキシ-13-[(2S,5S)-5-[(1R)-1-ヒドロキシトリデシル]オキソラン-2-イル]トリデシル]-2,5-ジヒドロフラン-2-オン
5-methyl-3-[(13S)-2,8,13-trihydroxy-13-[(2S,5S)-5-[(1R)-1-hydroxytridecyl]oxolan-2-yl]tridecyl]-2,5-dihydrofuran-2-one
Other name (1):
3-[(13S)-13-[[(2S,5S)-5-[(R)-1-Hydroxytridecyl]tetrahydrofuran]-2-yl]-2,8,13-trihydroxytridecyl]-5-methylfuran-2(5H)-one
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