CHEBI:95119 - LSM-6384

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name LSM-6384
ChEBI ID CHEBI:95119
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C22H27NO2
Net Charge 0
Average Mass 337.456
Monoisotopic Mass 337.20418
InChI InChI=1S/C22H27NO2/c1-4-22(24)10-8-18-16-6-5-15-11-19-14(13-23-25-19)12-20(15,2)17(16)7-9-21(18,22)3/h1,11,13,16-18,24H,5-10,12H2,2-3H3/t16?,17?,18?,20?,21?,22-/m0/s1
InChIKey POZRVZJJTULAOH-ZIKCMSSPSA-N
SMILES CC12CCC3C(C1CC[C@]2(C#C)O)CCC4=CC5=C(CC34C)C=NO5
ChEBI Ontology
Outgoing LSM-6384 (CHEBI:95119) has parent hydride estrane (CHEBI:23966)
LSM-6384 (CHEBI:95119) is a steroid (CHEBI:35341)
Manual Xref Database
LSM-6384 LINCS
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