Preferred Name |
demegestone |
|
Synonyms |
lutionex |
|
ID |
http://purl.obolibrary.org/obo/CHEBI_135339 |
|
charge |
0 |
|
database_cross_reference |
Drug_Central:803 CAS:10116-22-0 |
|
formula |
C21H28O2 |
|
has_obo_namespace |
chebi_ontology |
|
has_related_synonym |
lutionex |
|
id |
CHEBI:135339 |
|
in_subset | ||
inchi |
InChI=1S/C21H28O2/c1-13(22)20(2)11-9-19-18-6-4-14-12-15(23)5-7-16(14)17(18)8-10-21(19,20)3/h12,18-19H,4-11H2,1-3H3/t18-,19+,20-,21+/m1/s1 |
|
inchikey |
JWAHBTQSSMYISL-MHTWAQMVSA-N |
|
label |
demegestone |
|
mass |
312.447 |
|
monoisotopicmass |
312.20893 |
|
notation |
CHEBI:135339 |
|
prefLabel |
demegestone |
|
smiles |
C[C@@]12[C@]([C@]3(C(CC1)=C4C(CC3)=CC(CC4)=O)[H])(CC[C@@]2(C(C)=O)C)[H] |
|
treeView | ||
subClassOf |
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