ChEBI
  Marvin  09080512592D          

  6  6  0  0  0  0            999 V2000
    5.7515   -3.1808    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    6.4141   -3.6509    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1793   -4.4467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3510   -4.4468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0895   -3.6731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7414   -2.3558    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  5  1  1  0  0  0  0
  6  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
M  END
> <ID>
CHEBI:16133

> <NAME>
cyclopentanol

> <DEFINITION>
The simplest member of the class of  cyclopentanols bearing a single hydroxy substituent. The parent of the class of cyclopentanols.

> <STAR>
3

> <SECONDARY_ID>
CHEBI:4022; CHEBI:14057; CHEBI:23494

> <SYNONYM>
Hydroxycyclopentane; Cyclopentyl alcohol; cyclopentanol; Cyclopentanol

> <IUPAC_NAME>
cyclopentanol

> <FORMULA>
C5H10O

> <MASS>
86.13230

> <MONOISOTOPIC_MASS>
86.07316

> <CHARGE>
0

> <SMILES>
OC1CCCC1

> <INCHI>
InChI=1S/C5H10O/c6-5-3-1-2-4-5/h5-6H,1-4H2

> <INCHIKEY>
XCIXKGXIYUWCLL-UHFFFAOYSA-N

> <CAS_REGISTRY_NUMBER>
96-41-3

> <REAXYS_REGISTRY_NUMBER>
1900556

> <CHEMIDPLUS>
96-41-3

> <KEGG_COMPOUND_ACCESSION>
C02020

> <METACYC_ACCESSION>
CYCLOPENTANOL

> <NIST_CHEMISTRY_WEBBOOK>
96-41-3

> <WIKIPEDIA_ACCESSION>
Cyclopentanol

> <PUBMED_CITATION>
22145629; 24273356

$$$$