Chem
J-GLOBAL ID:200907050723493371   Nikkaji number:J2.595.958B

Bastadin 24

バスタジン24
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: C34H26Br6N4O9
Molecular formula furigana: C34-H26-BR6-N4-O9
Molecular weight: 1114.025
InChI: InChI=1S/C34H26Br6N4O9/c35-18-5-15-2-4-42-34(49)27(44-51)28(45)17-12-22(39)32(23(40)13-17)53-26-11-16(8-19(36)30(26)47)9-24(43-50)33(48)41-3-1-14-6-20(37)31(21(38)7-14)52-25(10-15)29(18)46/h5-8,10-13,28,45-47,50-51H,1-4,9H2,(H,41,48)(H,42,49)
InChI key: MHAGECXZXFMEGD-UHFFFAOYSA-N
SMILES: ON=C1Cc2cc(Br)c(O)c(Oc3c(Br)cc(cc3Br)C(O)C(=NO)C(=O)NCCc3cc(Br)c(O)c(Oc4c(Br)cc(CCNC1=O)cc4Br)c3)c2
Systematic name  (3):
  • 3,19,28-トリヒドロキシ-4,15,20,31,33,36-ヘキサブロモ-8,27-ビス(ヒドロキシイミノ)-2,6:22,18-ジメテノ-13,16:29,32-ジエテノ-1,17-ジオキサ-10,25-ジアザシクロドトリアコンタン-2,4,13,15,19,21,29,31-オクタエン-9,26-ジオン
  • 5,16,21,32,33,36-ヘキサブロモ-4,13,20-トリヒドロキシ-12,25-ビス(ヒドロキシイミノ)-2,18-ジオキサ-10,27-ジアザペンタシクロ[28.2.2.214,17.13,7.119,23]オクタトリアコンタ-1(32),3(38),4,6,14,16,19(35),20,22,30,33,36-ドデカエン-11,26-ジオン
  • 5,16,21,32,33,36-hexabromo-4,13,20-trihydroxy-12,25-bis(hydroxyimino)-2,18-dioxa-10,27-diazapentacyclo[28.2.2.214,17.13,7.119,23]octatriaconta-1(32),3(38),4,6,14,16,19(35),20,22,30,33,36-dodecaene-11,26-dione
Other name (3):
  • 3,19,28-Trihydroxy-4,15,20,31,33,36-hexabromo-8,27-bis(hydroxyimino)-2,6:22,18-dimetheno-13,16:29,32-dietheno-1,17-dioxa-10,25-diazacyclodotriacontane-2,4,13,15,19,21,29,31-octaene-9,26-dione
  • バスタジン24
  • Bastadin 24
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