Chem
J-GLOBAL ID:201007024097412178   Nikkaji number:J2.829.570G

Aspergillide A

アスペルギリド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: C14H22O4
Molecular formula furigana: C14-H22-O4
Molecular weight: 254.326
InChI: InChI=1S/C14H22O4/c1-10-5-3-2-4-6-11-7-8-12(15)13(18-11)9-14(16)17-10/h4,6,10-13,15H,2-3,5,7-9H2,1H3/b6-4-/t10-,11-,12-,13+/m0/s1
InChI key: FDJDTDDUDZAAFP-QZQAYEGZSA-N
SMILES: C[C@H]1CCC/C=C\[C@H]2CC[C@H](O)[C@@H](CC(=O)O1)O2
Systematic name  (3):
  • (1R,5S,9E,11α)-5-メチル-14α-ヒドロキシ-4,15-ジオキサビシクロ[9.3.1]ペンタデカ-9-エン-3-オン
  • (1R,5S,9Z,11R,14S)-14-ヒドロキシ-5-メチル-4,15-ジオキサビシクロ[9.3.1]ペンタデカ-9-エン-3-オン
  • (1R,5S,9Z,11R,14S)-14-hydroxy-5-methyl-4,15-dioxabicyclo[9.3.1]pentadec-9-en-3-one
Other name (5):
  • (1R,5S,9E,11α)-5-Methyl-14α-hydroxy-4,15-dioxabicyclo[9.3.1]pentadec-9-en-3-one
  • (-)-アスペルギリドA
  • (-)-Aspergillide A
  • アスペルギリドA
  • Aspergillide A
CAS registry number: 1113061-38-3
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