BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
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Dihydroconiferyl Alcohol

Dihydroconiferyl Alcohol synonyms

1-Propanol, 3-(4-hydroxy-3-methoxyphenyl); Dihydroconiferyl alcohol

Wikipedia:

Graphical representations:

dihydroconiferyl alcohol image

Molecular Formula: C10 H14 O3

Natural Isotopic Abundance Mass: 182.21636

Mono-Isotopic Molecular Masses:

  • C12N14: 182.0942943157
  • C13N14: 192.1278426937
  • C12N15: 182.0942943157
  • C13N15: 192.1278426937

InCHi String:

canonical and isomeric SMILES: COC1=C(C=CC(=C1)CCCO)O

PUBCHEM iupac NAME: PUBCHEM iupac CAS NAME
4-(3-hydroxypropyl)-2-methoxyphenol

PUBCHEM iupac TRADITIONAL NAME: PUBCHEM iupac OPENEYE NAME: PUBCHEM iupac SYSTEMATIC NAME
4-(3-hydroxypropyl)-2-methoxy-phenol

PubChem Substance (SID):   85165361   12631   10514500
PubChem Compound (CID):   16822
KEGG: Compound ID   C10448
CAS Registry IDs:   2305-13-7
PDB Chemical Component   n/a
Miscellaneous Databases and IDs:   ChemDB 4950341   NIST Chemistry WebBook 2287996778   MMCD cq_07113

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.