Chem
J-GLOBAL ID:200907022418448842
Nikkaji number:J2.617.009E
4,10-Deoxypyranicin
4,10-ジデオキシピラニシン
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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 O5
Molecular formula furigana:
C35-H64-O5
Molecular weight:
564.892
InChI:
InChI=1S/C35H64O5/c1-3-4-5-6-7-8-13-16-19-22-25-33-32(37)26-27-34(40-33)31(36)24-21-18-15-12-10-9-11-14-17-20-23-30-28-29(2)39-35(30)38/h28-29,31-34,36-37H,3-27H2,1-2H3/t29-,31+,32+,33+,34+/m0/s1
InChI key:
VQQKSZWQASCCJP-OTUMHNDOSA-N
SMILES:
CCCCCCCCCCCC[C@H]1O[C@H](CC[C@H]1O)[C@H](O)CCCCCCCCCCCCC1=C[C@H](C)OC1=O
Systematic name (4):
(5S)-3-[(13R)-13-ヒドロキシ-13-[(2R)-5β-ヒドロキシ-6β-ドデシルテトラヒドロ-2H-ピラン-2β-イル]トリデシル]-5-メチル-2,5-ジヒドロフラン-2-オン
(5S)-3-[(13R)-13-ヒドロキシ-13-[[(2R)-5β-ヒドロキシ-6β-ドデシルテトラヒドロ-2H-ピラン]-2β-イル]トリデシル]-5-メチル-2,5-ジヒドロフラン-2-オン
(5S)-3-[(13R)-13-[(2R,5R,6R)-6-ドデシル-5-ヒドロキシオキサン-2-イル]-13-ヒドロキシトリデシル]-5-メチル-2,5-ジヒドロフラン-2-オン
(5S)-3-[(13R)-13-[(2R,5R,6R)-6-dodecyl-5-hydroxyoxan-2-yl]-13-hydroxytridecyl]-5-methyl-2,5-dihydrofuran-2-one
Other name (4):
(5S)-3-[(13R)-13-Hydroxy-13-[(2R)-5β-hydroxy-6β-dodecyltetrahydro-2H-pyran-2β-yl]tridecyl]-5-methyl-2,5-dihydrofuran-2-one
4,10-ジデオキシピラニシン
4,10-Deoxypyranicin
(5S)-3-[(13R)-13-Hydroxy-13-[[(2R)-5β-hydroxy-6β-dodecyltetrahydro-2H-pyran]-2β-yl]tridecyl]-5-methyl-2,5-dihydrofuran-2-one
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