Chem
J-GLOBAL ID：201707004070297521   Nikkaji number：J3.666.300F

(5R,6R,7R,10Z)-1,4,5,6,7,8,9,12-Octahydro-1,4-dioxo-3-amino-5-hydroxy-6,7-epoxy-11-methylbenzocyclodecene-7-carboxylic acid lactone

クラビラクトンD
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： C16H15NO5
Molecular formula furigana： C16-H15-N-O5
Molecular weight： 301.298
InChI： InChI=1S/C16H15NO5/c1-7-3-2-4-16-14(22-16)13(21-15(16)20)11-8(5-7)10(18)6-9(17)12(11)19/h3,6,13-14H,2,4-5,17H2,1H3/b7-3-/t13-,14-,16-/m1/s1
InChI key： JPXJOSVTNUCCKM-YCWOYDOZSA-N
SMILES： C/C/1=C/CC[C@@]23O[C@@H]2[C@H](OC3=O)C2=C(C1)C(=O)C=C(N)C2=O
Systematic name  (4)：
  • (5R,6R,7R,10Z)-1,4-ジオキソ-3-アミノ-5β-ヒドロキシ-11-メチル-6β,7α-エポキシ-1,4,5,6,7,8,9,12-オクタヒドロベンゾシクロデセン-7-カルボン酸ラクトン
  • (5R,6R,7R,10Z)-1,4,5,6,7,8,9,12-オクタヒドロ-1,4-ジオキソ-3-アミノ-5-ヒドロキシ-6,7-エポキシ-11-メチルベンゾシクロデセン-7-カルボン酸ラクトン
  • (1R,4Z,13R,14R)-10-アミノ-5-メチル-15,17-ジオキサテトラシクロ[11.2.2.01,14.07,12]ヘプタデカ-4,7(12),9-トリエン-8,11,16-トリオン
  • (1R,4Z,13R,14R)-10-amino-5-methyl-15,17-dioxatetracyclo[11.2.2.01,14.07,12]heptadeca-4,7(12),9-triene-8,11,16-trione
Other name (3)：
  • (5R,6R,7R,10Z)-1,4-Dioxo-3-amino-5β-hydroxy-11-methyl-6β,7α-epoxy-1,4,5,6,7,8,9,12-octahydrobenzocyclodecene-7-carboxylic acid lactone
  • (5R,6R,7R,10Z)-1,4,5,6,7,8,9,12-Octahydro-1,4-dioxo-3-amino-5-hydroxy-6,7-epoxy-11-methylbenzocyclodecene-7-carboxylic acid lactone
  • クラビラクトンD
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