Chem
J-GLOBAL ID：200907091407824585   Nikkaji number：J14.585H

Glaucolide B

グラウコリド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： C21H26O10
Molecular formula furigana： C21-H26-O10
Molecular weight： 438.429
InChI： InChI=1S/C21H26O10/c1-10(22)27-9-13-16-14(28-11(2)23)8-21(5,30-12(3)24)15(25)6-7-20(4)18(31-20)17(16)29-19(13)26/h14,17-18H,6-9H2,1-5H3/t14?,17-,18+,20+,21+/m0/s1
InChI key： JNLNEIIZZQABDP-CVFWYCRKSA-N
SMILES： CC(=O)OCC1=C2[C@H](OC1=O)[C@H]1O[C@]1(C)CCC(=O)[C@@](C)(CC2OC(=O)C)OC(=O)C
Systematic name  (3)：
  • (1aR,5R,7S,10aS,10bR)-5,7-ジアセトキシ-8-アセトキシメチル-2,3,6,7,10a,10b-ヘキサヒドロ-1a,5-ジメチルオキシレノ[9,10]シクロデカ[1,2-b]フラン-4,9(1aH,5H)-ジオン
  • [(1S,2R,4R,8R,10S)-8,10-ビス(アセチルオキシ)-4,8-ジメチル-7,13-ジオキソ-3,14-ジオキサトリシクロ[9.3.0.02,4]テトラデカ-11-エン-12-イル]メチル アセタート
  • [(1S,2R,4R,8R,10S)-8,10-bis(acetyloxy)-4,8-dimethyl-7,13-dioxo-3,14-dioxatricyclo[9.3.0.02,4]tetradec-11-en-12-yl]methyl acetate
Other name (3)：
  • グラウコリドB
  • Glaucolide B
  • (1aR,5R,7S,10aS,10bR)-5,7-Diacetoxy-8-acetoxymethyl-2,3,6,7,10a,10b-hexahydro-1a,5-dimethyloxireno[9,10]cyclodeca[1,2-b]furan-4,9(1aH,5H)-dione
CAS registry number： 11091-27-3
KEGG COMPOUND： C09465
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