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Substance Name: Isopilosine
RN: 491-88-3
UNII: E82V5ZLP85
InChIKey: DZOVBAVEJYPSLL-QEJZJMRPSA-N

Molecular Formula

  • C16-H18-N2-O3

Molecular Weight

  • 286.329
 
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Names and Synonyms

Name of Substance

  • Isopilosine

Synonyms

  • EINECS 207-745-2
  • NSC 77211
  • UNII-E82V5ZLP85

Systematic Name

  • (3S-(3alpha(S*),4beta))-Dihydro-3-(alpha-hydroxybenzyl)-4-((1-methyl-1H-imidazol-5-yl)methyl)furan-2(3H)-one

Registry Numbers

CAS Registry Number

  • 491-88-3

FDA UNII

  • E82V5ZLP85

System Generated Number

  • 0000491883

Structure Descriptors

InChI

1S/C16H18N2O3/c1-18-10-17-8-13(18)7-12-9-21-16(20)14(12)15(19)11-5-3-2-4-6-11/h2-6,8,10,12,14-15,19H,7,9H2,1H3/t12-,14-,15-/m0/s1

InChIKey

DZOVBAVEJYPSLL-QEJZJMRPSA-N

Smiles

C1([C@@H]([C@@H](Cc2n(cnc2)C)CO1)[C@H](c1ccccc1)O)=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 179 deg C   EXP

Physical property data is provided to ChemIDplus by SRC, Inc.