Chem
J-GLOBAL ID:200907051561535195   Nikkaji number:J688.263C

Chloromarmin

クロロマルミン
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: C19H23ClO4
Molecular formula furigana: C19-H23-CL-O4
Molecular weight: 350.840
InChI: InChI=1S/C19H23ClO4/c1-13(4-8-17(21)19(2,3)20)10-11-23-15-7-5-14-6-9-18(22)24-16(14)12-15/h5-7,9-10,12,17,21H,4,8,11H2,1-3H3/b13-10+/t17-/m1/s1
InChI key: LJKOFXGMGDOURN-JIIJFUIFSA-N
SMILES: C/C(=C\COc1ccc2ccc(=O)oc2c1)/CC[C@@H](O)C(C)(C)Cl
Systematic name  (3):
  • 7-[[(2E,6R)-7-クロロ-6-ヒドロキシ-3,7-ジメチル-2-オクテニル]オキシ]クマリン
  • 7-{[(2E,6R)-7-クロロ-6-ヒドロキシ-3,7-ジメチルオクタ-2-エン-1-イル]オキシ}-2H-クロメン-2-オン
  • 7-{[(2E,6R)-7-chloro-6-hydroxy-3,7-dimethyloct-2-en-1-yl]oxy}-2H-chromen-2-one
Other name (3):
  • クロロマルミン
  • Chloromarmin
  • 7-[[(2E,6R)-7-Chloro-6-hydroxy-3,7-dimethyl-2-octenyl]oxy]coumarin
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