Chem
J-GLOBAL ID：200907012432435103   Nikkaji number：J2.768.608G

Hallactone A

ハルラクトン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： C19H22O6
Molecular formula furigana： C19-H22-O6
Molecular weight： 346.379
InChI： InChI=1S/C19H22O6/c1-7(2)12-8-5-10-14-18(3,9(8)6-11(20)24-12)16-13(25-16)15(21)19(14,4)17(22)23-10/h6-7,10,13-16,21H,5H2,1-4H3/t10-,13+,14-,15+,16+,18-,19-/m0/s1
InChI key： WXJASYTWXBVSQZ-VYHJHLSGSA-N
SMILES： CC(C)c1oc(=O)cc2c1C[C@@H]1OC(=O)[C@@]3(C)[C@@H]1[C@@]2(C)[C@@H]1O[C@@H]1[C@H]3O
Systematic name  (3)：
  • (1aR)-1aβ,2,2a,4aα,4bα,5,9b,9cβ-オクタヒドロ-2β-ヒドロキシ-2aα,9bβ-ジメチル-6-イソプロピル-3H,8H-フロ[2′,3′,4′:4,5]オキシレノ[7,8]ナフト[2,1-c]ピラン-3,8-ジオン
  • (1R,2S,4R,5S,6S,9S,17S)-5-ヒドロキシ-1,6-ジメチル-12-(プロパン-2-イル)-3,8,13-トリオキサペンタシクロ[7.7.1.02,4.06,17.011,16]ヘプタデカ-11,15-ジエン-7,14-ジオン
  • (1R,2S,4R,5S,6S,9S,17S)-5-hydroxy-1,6-dimethyl-12-(propan-2-yl)-3,8,13-trioxapentacyclo[7.7.1.02,4.06,17.011,16]heptadeca-11,15-diene-7,14-dione
Other name (3)：
  • (1aR)-1aβ,2,2a,4aα,4bα,5,9b,9cβ-Octahydro-2β-hydroxy-2aα,9bβ-dimethyl-6-isopropyl-3H,8H-furo[2′,3′,4′:4,5]oxireno[7,8]naphtho[2,1-c]pyran-3,8-dione
  • Hallactone A
  • ハルラクトンA
CAS registry number： 41787-72-8
KEGG COMPOUND： C09104
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM