Chem
J-GLOBAL ID:200907025532513203   Nikkaji number:J2.201.508G

1β,4β-Epidioxynaphthalene-1,4-dipropionic acid disodium salt

1β,4β-エピジオキシナフタレン-1,4-ジプロピオン酸ジナトリウム
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: C16H14Na2O6
Molecular formula furigana: C16-H14-NA2-O6
Molecular weight: 348.262
InChI: InChI=1S/C16H16O6.2Na/c17-13(18)5-7-15-9-10-16(22-21-15,8-6-14(19)20)12-4-2-1-3-11(12)15;;/h1-4,9-10H,5-8H2,(H,17,18)(H,19,20);;/q;2*+1/p-2/t15-,16+;;
InChI key: CBEIYHCNKUAXRX-TYIJTUDGSA-L
SMILES: [Na]OC(=O)CC[C@@]12OO[C@@](CCC(=O)O[Na])(C=C1)c1ccccc21
Systematic name  (3):
  • 1β,4β-エピジオキシナフタレン-1,4-ジプロピオン酸ジナトリウム
  • ナトリウム 3-[(1S,8R)-8-[3-オキソ-3-(ソジオオキシ)プロピル]-9,10-ジオキサトリシクロ[6.2.2.02,7]ドデカ-2,4,6,11-テトラエン-1-イル]プロパノアート
  • sodium 3-[(1S,8R)-8-[3-oxo-3-(sodiooxy)propyl]-9,10-dioxatricyclo[6.2.2.02,7]dodeca-2,4,6,11-tetraen-1-yl]propanoate
Other name (1):
  • 1β,4β-Epidioxynaphthalene-1,4-dipropionic acid disodium salt
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