Preferred Name |
norgestrel |
|
Synonyms |
Norgestrel 17-ethynyl-17-hydroxy-18a-homoestr-4-en-3-one norgestrelum LD norgestrel norgestrel Methylnorethindrone |
|
ID |
http://purl.obolibrary.org/obo/CHEBI_7630 |
|
charge |
0 |
|
database_cross_reference |
KEGG:C08153 DrugBank:DB00506 Beilstein:4149572 CAS:6533-00-2 Patent:US3959322 KEGG:D00954 Patent:BE623844 |
|
formula |
C21H28O2 |
|
has_exact_synonym |
Norgestrel 17-ethynyl-17-hydroxy-18a-homoestr-4-en-3-one |
|
has_obo_namespace |
chebi_ontology |
|
has_related_synonym |
norgestrelum LD norgestrel norgestrel Methylnorethindrone |
|
id |
CHEBI:7630 |
|
in_subset | ||
inchi |
InChI=1S/C21H28O2/c1-3-20-11-9-17-16-8-6-15(22)13-14(16)5-7-18(17)19(20)10-12-21(20,23)4-2/h2,13,16-19,23H,3,5-12H2,1H3 |
|
inchikey |
WWYNJERNGUHSAO-UHFFFAOYSA-N |
|
label |
norgestrel |
|
mass |
312.44582 |
|
monoisotopicmass |
312.20893 |
|
notation |
CHEBI:7630 |
|
prefLabel |
norgestrel |
|
smiles |
CCC12CCC3C(CCC4=CC(=O)CCC34)C1CCC2(O)C#C |
|
treeView |
http://purl.obolibrary.org/obo/CHEBI_36838 |
|
subClassOf |
http://purl.obolibrary.org/obo/CHEBI_36838 |
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