Chem
J-GLOBAL ID:200907051785121205   Nikkaji number:J1.006.481C

4,4′-[[[(1R,2E,6S,10E,11aS,13S,14aR)-1,6,7,8,9,11a,12,13,14,14a-Decahydro-4-oxo-6-methyl-4H-cyclopenta[f]oxacyclotridecin]-1,13-diyl]bis(oxy)]bis(4-oxobutyric acid)

4,4′-[[[(1R,2E,6S,10E,11aS,13S,14aR)-1,6,7,8,9,11a,12,13,14,14a-デカヒドロ-4-オキソ-6-メチル-4H-シクロペンタ[f]オキサシクロトリデシン]-1,13-ジイル]ビス(オキシ)]ビス(4-オキソ酪酸)
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: C24H32O10
Molecular formula furigana: C24-H32-O10
Molecular weight: 480.510
InChI: InChI=1S/C24H32O10/c1-15-5-3-2-4-6-16-13-17(33-23(30)11-8-20(25)26)14-18(16)19(7-10-22(29)32-15)34-24(31)12-9-21(27)28/h4,6-7,10,15-19H,2-3,5,8-9,11-14H2,1H3,(H,25,26)(H,27,28)/b6-4+,10-7+/t15-,16+,17-,18+,19+/m0/s1
InChI key: FQORATIVDWCNFI-MHZVUYPHSA-N
SMILES: C[C@H]1CCC/C=C/[C@@H]2C[C@@H](C[C@H]2[C@H](OC(=O)CCC(=O)O)/C=C/C(=O)O1)OC(=O)CCC(=O)O
Systematic name  (3):
  • 4,4′-[[[(1R,2E,6S,10E,11aS,13S,14aR)-1,6,7,8,9,11a,12,13,14,14a-デカヒドロ-4-オキソ-6-メチル-4H-シクロペンタ[f]オキサシクロトリデシン]-1,13-ジイル]ビス(オキシ)]ビス(4-オキソ酪酸)
  • 4-{[(1R,6S,11aS,13S,14aR)-1-[(3-カルボキシプロパノイル)オキシ]-6-メチル-4-オキソ-1H,4H,6H,7H,8H,9H,11aH,12H,13H,14H,14aH-シクロペンタ[f]オキサシクロトリデカン-13-イル]オキシ}-4-オキソブタン酸
  • 4-{[(1R,6S,11aS,13S,14aR)-1-[(3-carboxypropanoyl)oxy]-6-methyl-4-oxo-1H,4H,6H,7H,8H,9H,11aH,12H,13H,14H,14aH-cyclopenta[f]oxacyclotridecan-13-yl]oxy}-4-oxobutanoic acid
Other name (1):
  • 4,4′-[[[(1R,2E,6S,10E,11aS,13S,14aR)-1,6,7,8,9,11a,12,13,14,14a-Decahydro-4-oxo-6-methyl-4H-cyclopenta[f]oxacyclotridecin]-1,13-diyl]bis(oxy)]bis(4-oxobutyric acid)
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