Chem
J-GLOBAL ID：200907073199758028   Nikkaji number：J19.400J

Rubratoxin A

ルブラトキシンA
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： C26H32O11
Molecular formula furigana： C26-H32-O11
Molecular weight： 520.530
InChI： InChI=1S/C26H32O11/c1-2-3-4-5-7-15(27)20-18-13(23(31)36-25(18)33)10-12(21(29)16-8-6-9-17(28)35-16)11-14-19(22(20)30)26(34)37-24(14)32/h6,9,12,15-16,20-23,27,29-31H,2-5,7-8,10-11H2,1H3
InChI key： XOEFANNJIKAWGX-UHFFFAOYSA-N
SMILES： CCCCCCC(O)C1C(O)C2=C(CC(CC3=C1C(=O)OC3O)C(O)C1CC=CC(=O)O1)C(=O)OC2=O
Systematic name  (3)：
  • 10-[(3,6-ジヒドロ-6-オキソ-2H-ピラン-2-イル)ヒドロキシメチル]-4,5,8,9,10,11-ヘキサヒドロ-4,8-ジヒドロキシ-5-(1-ヒドロキシヘプチル)-1H-シクロノナ[1,2-c:5,6-c′]ジフラン-1,3,6-トリオン
  • 3,13-ジヒドロキシ-10-[ヒドロキシ(6-オキソ-3,6-ジヒドロ-2H-ピラン-2-イル)メチル]-2-(1-ヒドロキシヘプチル)-6,14-ジオキサトリシクロ[10.3.0.04,8]ペンタデカ-1(12),4(8)-ジエン-5,7,15-トリオン
  • 3,13-dihydroxy-10-[hydroxy(6-oxo-3,6-dihydro-2H-pyran-2-yl)methyl]-2-(1-hydroxyheptyl)-6,14-dioxatricyclo[10.3.0.04,8]pentadeca-1(12),4(8)-diene-5,7,15-trione
Other name (3)：
  • ルブラトキシンA
  • Rubratoxin A
  • 10-[(3,6-Dihydro-6-oxo-2H-pyran-2-yl)hydroxymethyl]-4,5,8,9,10,11-hexahydro-4,8-dihydroxy-5-(1-hydroxyheptyl)-1H-cyclonona[1,2-c:5,6-c′]difuran-1,3,6-trione
CAS registry number： 22467-31-8
Application (1)：
mycotoxin
Thsaurus map：
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