Chem
J-GLOBAL ID:201507080289266250
Nikkaji number:J3.394.394F
(2S)-2-((4R,5S,6R)-2,2,5-Trimethyl-6-(10-(tert-butylcarbonyloxy)decyl)-1,3-dioxane-4-yl)propane-1-ol
(2S)-2-((4R,5S,6R)-2,2,5-トリメチル-6-(10-(tert-ブチルカルボニルオキシ)デシル)-1,3-ジオキサン-4-イル)プロパン-1-オール
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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:
C25 H48 O5
Molecular formula furigana:
C25-H48-O5
Molecular weight:
428.654
InChI:
InChI=1S/C25H48O5/c1-19(18-26)22-20(2)21(29-25(6,7)30-22)16-14-12-10-8-9-11-13-15-17-28-23(27)24(3,4)5/h19-22,26H,8-18H2,1-7H3/t19-,20-,21+,22+/m0/s1
InChI key:
NSRWWELGSCDASJ-FNAHDJPLSA-N
SMILES:
C[C@@H](CO)[C@H]1OC(C)(C)O[C@H](CCCCCCCCCCOC(=O)C(C)(C)C)[C@@H]1C
Systematic name (3):
(2S)-2-((4R,5S,6R)-2,2,5-トリメチル-6-(10-(tert-ブチルカルボニルオキシ)デシル)-1,3-ジオキサン-4-イル)プロパン-1-オール
10-[(4R,5S,6R)-6-[(2S)-1-ヒドロキシプロパン-2-イル]-2,2,5-トリメチル-1,3-ジオキサン-4-イル]デシル 2,2-ジメチルプロパノアート
10-[(4R,5S,6R)-6-[(2S)-1-hydroxypropan-2-yl]-2,2,5-trimethyl-1,3-dioxan-4-yl]decyl 2,2-dimethylpropanoate
Other name (1):
(2S)-2-((4R,5S,6R)-2,2,5-Trimethyl-6-(10-(tert-butylcarbonyloxy)decyl)-1,3-dioxane-4-yl)propane-1-ol
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