Chem
J-GLOBAL ID：200907030949189283
Nikkaji number：J1.722.946J
5,17-Dibromopentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecene-25,26,27,28-tetrol
5,17-ジブロモペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-ドデカエン-25,26,27,28-テトラオール
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
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
Molecular formula： C28H22Br2O4
Molecular formula furigana： C28-H22-BR2-O4
Molecular weight： 582.288
InChI：
InChI=1S/C28H22Br2O4/c29-23-11-19-7-15-3-1-4-16(25(15)31)8-20-12-24(30)14-22(28(20)34)10-18-6-2-5-17(26(18)32)9-21(13-23)27(19)33/h1-6,11-14,31-34H,7-10H2
InChI key：
WQESWRXXQQFZFW-UHFFFAOYSA-N
SMILES：
Oc1c2Cc3cc(Br)cc(Cc4cccc(Cc5cc(Br)cc(Cc1ccc2)c5O)c4O)c3O
Systematic name (2)：
- 5,17-ジブロモペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-ドデカエン-25,26,27,28-テトラオール
- 5,17-dibromopentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene-25,26,27,28-tetrol
- 5,17-Dibromopentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecene-25,26,27,28-tetrol
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