CHEBI:79635 - 2alpha-Methylpregn-4-ene-3,20-dione

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ChEBI Name 2alpha-Methylpregn-4-ene-3,20-dione
ChEBI ID CHEBI:79635
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C22H32O2
Net Charge 0
Average Mass 328.48830
Monoisotopic Mass 328.24023
InChI InChI=1S/C22H32O2/c1-13-12-22(4)15(11-20(13)24)5-6-16-18-8-7-17(14(2)23)21(18,3)10-9-19(16)22/h11,13,16-19H,5-10,12H2,1-4H3/t13-,16+,17-,18+,19+,21-,22+/m1/s1
InChIKey SGQKAJDGWMDIOH-YJIAGASKSA-N
SMILES C[C@@H]1C[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC[C@@H]4C(C)=O)[C@@H]3CCC2=CC1=O
Roles Classification
Biological Role(s): hormone
Originally referring to an endogenous compound that is formed in specialized organ or group of cells and carried to another organ or group of cells, in the same organism, upon which it has a specific regulatory function, the term is now commonly used to include non-endogenous, semi-synthetic and fully synthetic analogues of such compounds.
(via steroid hormone )
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ChEBI Ontology
Outgoing 2alpha-Methylpregn-4-ene-3,20-dione (CHEBI:79635) is a corticosteroid hormone (CHEBI:36699)
Synonym Source
2alpha-Methylprogesterone KEGG COMPOUND
Manual Xref Database
C15116 KEGG COMPOUND
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Registry Number Type Source
2636-91-1 CAS Registry Number KEGG COMPOUND