CHEBI:79782 - 16alpha,17-Isopropylidenedioxy-6alpha-methylprogesterone

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ChEBI Name 16alpha,17-Isopropylidenedioxy-6alpha-methylprogesterone
ChEBI ID CHEBI:79782
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C25H36O4
Net Charge 0
Average Mass 400.55090
Monoisotopic Mass 400.26136
InChI InChI=1S/C25H36O4/c1-14-11-17-18(23(5)9-7-16(27)12-19(14)23)8-10-24(6)20(17)13-21-25(24,15(2)26)29-22(3,4)28-21/h12,14,17-18,20-21H,7-11,13H2,1-6H3/t14-,17+,18-,20-,21+,23+,24-,25+/m0/s1
InChIKey YWMWIAVBBQGFEY-MTJPYDJLSA-N
SMILES C[C@H]1C[C@H]2[C@@H]3C[C@H]4OC(C)(C)O[C@@]4(C(C)=O)[C@@]3(C)CC[C@@H]2[C@@]2(C)CCC(=O)C=C12
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 16alpha,17-Isopropylidenedioxy-6alpha-methylprogesterone (CHEBI:79782) is a corticosteroid hormone (CHEBI:36699)
Synonym Source
16alpha,17-Dihydroxy-6alpha-methylpregn-4-ene-3,20-dione cyclic acetal with acetone KEGG COMPOUND
Manual Xref Database
C15280 KEGG COMPOUND
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