Chem
J-GLOBAL ID：200907044593225272   Nikkaji number：J2.445.405C

(3S,4S,5S,6S,9R,10R)-1,10-Bis(4-bromobenzoyloxy)-3,5-diacetoxy-4,6-dimethyl-9-methoxyundecane

(3S,4S,5S,6S,9R,10R)-1,10-ビス(4-ブロモベンゾイルオキシ)-3,5-ジアセトキシ-4,6-ジメチル-9-メトキシウンデカン
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： C32H40Br2O9
Molecular formula furigana： C32-H40-BR2-O9
Molecular weight： 728.471
InChI： InChI=1S/C32H40Br2O9/c1-19(7-16-29(39-6)21(3)41-32(38)25-10-14-27(34)15-11-25)30(43-23(5)36)20(2)28(42-22(4)35)17-18-40-31(37)24-8-12-26(33)13-9-24/h8-15,19-21,28-30H,7,16-18H2,1-6H3/t19-,20-,21+,28-,29+,30-/m0/s1
InChI key： SDRKUTBVIWAGBU-GOBJUYSASA-N
SMILES： CO[C@H](CC[C@H](C)[C@H](OC(=O)C)[C@@H](C)[C@H](CCOC(=O)c1ccc(Br)cc1)OC(=O)C)[C@@H](C)OC(=O)c1ccc(Br)cc1
Systematic name  (3)：
  • (3S,4S,5S,6S,9R,10R)-1,10-ビス(4-ブロモベンゾイルオキシ)-3,5-ジアセトキシ-4,6-ジメチル-9-メトキシウンデカン
  • (3S,4S,5S,6S,9R,10R)-3-(アセチルオキシ)-1,10-ビス(4-ブロモベンゾイルオキシ)-9-メトキシ-4,6-ジメチルウンデカン-5-イル アセタート
  • (3S,4S,5S,6S,9R,10R)-3-(acetyloxy)-1,10-bis(4-bromobenzoyloxy)-9-methoxy-4,6-dimethylundecan-5-yl acetate
Other name (1)：
  • (3S,4S,5S,6S,9R,10R)-1,10-Bis(4-bromobenzoyloxy)-3,5-diacetoxy-4,6-dimethyl-9-methoxyundecane
Thsaurus map：
Thesaurus Map

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