Chem
J-GLOBAL ID:200907055622687517   Nikkaji number:J2.678.589H

Cylindradine B

シリンドラジンB
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: C11H11Br2N5O3
Molecular formula furigana: C11-H11-BR2-N5-O3
Molecular weight: 421.049
InChI: InChI=1S/C11H11Br2N5O3/c12-4-3-5(15-8(4)13)6-11(17-10(14)16-6)7(20)2(19)1-18(11)9(3)21/h2,6-7,15,19-20H,1H2,(H3,14,16,17)/t2-,6+,7+,11+/m0/s1
InChI key: PMIAEKSPKCHUBL-PJFHXCITSA-N
SMILES: NC1=N[C@@]23[C@H](O)[C@@H](O)CN2C(=O)c2c(Br)c(Br)[nH]c2[C@H]3N1
Systematic name  (4):
  • (1R,12α)-2α,3β-ジヒドロキシ-14-アミノ-8,9-ジブロモ-5,10,13,15-テトラアザテトラシクロ[10.3.0.01,5.07,11]ペンタデカン-7(11),8,14-トリエン-6-オン
  • 2,3-ジブロモ-7α,8β-ジヒドロキシ-11-アミノ-(8aα,9α-(イミノメタノイミノ)-4,6,7,8,8a,9-ヘキサヒドロ-1H-ピロロ[3,2-f]インドリジン)-11(12)-エン-4-オン
  • (1R,5R,14S,15S)-3-アミノ-8,9-ジブロモ-14,15-ジヒドロキシ-2,4,7,12-テトラアザテトラシクロ[10.3.0.01,5.06,10]ペンタデカ-2,6(10),8-トリエン-11-オン
  • (1R,5R,14S,15S)-3-amino-8,9-dibromo-14,15-dihydroxy-2,4,7,12-tetraazatetracyclo[10.3.0.01,5.06,10]pentadeca-2,6(10),8-trien-11-one
Other name (6):
  • (1R,12α)-2α,3β-Dihydroxy-14-amino-8,9-dibromo-5,10,13,15-tetraazatetracyclo[10.3.0.01,5.07,11]pentadecane-7(11),8,14-triene-6-one
  • シリンドラジンB
  • Cylindradine B
  • 2,3-Dibromo-7α,8β-dihydroxy-11-amino-(8aα,9α-(iminomethanimino)-4,6,7,8,8a,9-hexahydro-1H-pyrrolo[3,2-f]indolizine)-11(12)-ene-4-one
  • (+)-シリンドラジンB
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