Chem
J-GLOBAL ID：200907099823891411   Nikkaji number：J1.074.884D

Atranone D

アトラノン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： C24H34O4
Molecular formula furigana： C24-H34-O4
Molecular weight： 386.532
InChI： InChI=1S/C24H34O4/c1-13(2)17-12-20(26)24(6)10-9-15(4)22-18(11-14(3)7-8-19(17)24)21(16(5)25)23(27)28-22/h11-13,16,18-19,21,25H,7-10H2,1-6H3/b14-11+,22-15-/t16-,18-,19-,21+,24+/m0/s1
InChI key： CCMBGMOYVQDEBC-PDHNMVEYSA-N
SMILES： CC(C)C1=CC(=O)[C@]2(C)CC/C(=C/3\OC(=O)[C@H]([C@H](C)O)[C@@H]3/C=C(\C)/CC[C@@H]12)/C
Systematic name  (3)：
  • (1R,4E,8S,9S,10E,14S)-1,4,11-トリメチル-8-[(S)-1-ヒドロキシエチル]-15-イソプロピル-6-オキサトリシクロ[12.3.0.05,9]ヘプタデカン-4,10,15-トリエン-7,17-ジオン
  • (1R,4Z,8S,9S,10E,14S)-8-[(1S)-1-ヒドロキシエチル]-1,4,11-トリメチル-15-(プロパン-2-イル)-6-オキサトリシクロ[12.3.0.05,9]ヘプタデカ-4,10,15-トリエン-7,17-ジオン
  • (1R,4Z,8S,9S,10E,14S)-8-[(1S)-1-hydroxyethyl]-1,4,11-trimethyl-15-(propan-2-yl)-6-oxatricyclo[12.3.0.05,9]heptadeca-4,10,15-triene-7,17-dione
Other name (3)：
  • (1R,4E,8S,9S,10E,14S)-1,4,11-Trimethyl-8-[(S)-1-hydroxyethyl]-15-isopropyl-6-oxatricyclo[12.3.0.05,9]heptadecane-4,10,15-triene-7,17-dione
  • アトラノンD
  • Atranone D
CAS registry number： 227597-64-0
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