Preferred Name |
prednylidene |
|
Synonyms |
dacortilen dacorsol decortilen |
|
ID |
http://purl.obolibrary.org/obo/CHEBI_135572 |
|
charge |
0 |
|
database_cross_reference |
CAS:599-33-7 Drug_Central:2254 |
|
formula |
C22H28O5 |
|
has_obo_namespace |
chebi_ontology |
|
has_related_synonym |
dacortilen dacorsol decortilen |
|
id |
CHEBI:135572 |
|
in_subset | ||
inchi |
InChI=1S/C22H28O5/c1-12-8-16-15-5-4-13-9-14(24)6-7-20(13,2)19(15)17(25)10-21(16,3)22(12,27)18(26)11-23/h6-7,9,15-17,19,23,25,27H,1,4-5,8,10-11H2,2-3H3/t15-,16-,17-,19+,20-,21-,22-/m0/s1 |
|
inchikey |
WSVOMANDJDYYEY-CWNVBEKCSA-N |
|
label |
prednylidene |
|
mass |
372.456 |
|
monoisotopicmass |
372.19367 |
|
notation |
CHEBI:135572 |
|
prefLabel |
prednylidene |
|
smiles |
C[C@@]12[C@]([C@]3([C@]([C@H](C1)O)([C@]4(C)C(CC3)=CC(C=C4)=O)[H])[H])(CC([C@@]2(C(CO)=O)O)=C)[H] |
|
treeView | ||
subClassOf |
Create mapping