Chem
J-GLOBAL ID：201507084387464308   Nikkaji number：J3.359.846G

10-Me-aplog-1

10-メチルアプログ1
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： C28H40O8
Molecular formula furigana： C28-H40-O8
Molecular weight： 504.620
InChI： InChI=1S/C28H40O8/c1-18-23(10-5-4-7-19-8-6-9-20(30)13-19)36-28-16-24(18)34-26(32)15-22(17-29)33-25(31)14-21(35-28)11-12-27(28,2)3/h6,8-9,13,18,21-24,29-30H,4-5,7,10-12,14-17H2,1-3H3/t18-,21-,22-,23-,24+,28-/m1/s1
InChI key： SWKUTOXEFLDOID-PYCRRGESSA-N
SMILES： C[C@@H]1[C@@H](CCCCc2cccc(O)c2)O[C@]23C[C@@H]1OC(=O)C[C@H](CO)OC(=O)C[C@@H](CCC2(C)C)O3
Systematic name  (4)：
  • (1R,3R,4R,5S,9R,13R)-9-(ヒドロキシメチル)-3-[4-(3-ヒドロキシフェニル)ブチル]-4,16,16-トリメチル-2,6,10,17-テトラオキサトリシクロ[11.3.1.11,5]オクタデカン-7,11-ジオン
  • (4R)-4α-(ヒドロキシメチル)-11,11,15β-トリメチル-14α-[4-(3-ヒドロキシフェニル)ブチル]-8α,12α-エポキシ-12,16α-メタノ-1,5,13-トリオキサシクロヘキサデカン-2,6-ジオン
  • (2R,6R)-2β,10β-[(4R)-2,6-ジオキソ-4-(ヒドロキシメチル)-3,7-ジオキサヘプタン-1,7-ジイル]-5,5,9β-トリメチル-8α-[4-(3-ヒドロキシフェニル)ブチル]-1,7-ジオキサスピロ[5.5]ウンデカン
  • (1R,3R,4R,5S,9R,13R)-9-(hydroxymethyl)-3-[4-(3-hydroxyphenyl)butyl]-4,16,16-trimethyl-2,6,10,17-tetraoxatricyclo[11.3.1.11,5]octadecane-7,11-dione
Other name (5)：
  • (1R,3R,4R,5S,9R,13R)-9-(Hydroxymethyl)-3-[4-(3-hydroxyphenyl)butyl]-4,16,16-trimethyl-2,6,10,17-tetraoxatricyclo[11.3.1.11,5]octadecane-7,11-dione
  • (4R)-4α-(Hydroxymethyl)-11,11,15β-trimethyl-14α-[4-(3-hydroxyphenyl)butyl]-8α,12α-epoxy-12,16α-methano-1,5,13-trioxacyclohexadecane-2,6-dione
  • 10-メチルアプログ1
  • 10-Me-aplog-1
  • (2R,6R)-2β,10β-[(4R)-2,6-Dioxo-4-(hydroxymethyl)-3,7-dioxaheptane-1,7-diyl]-5,5,9β-trimethyl-8α-[4-(3-hydroxyphenyl)butyl]-1,7-dioxaspiro[5.5]undecane
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM