CHEBI:16744 - pregna-4,9(11)-diene-3,20-dione

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ChEBI Name pregna-4,9(11)-diene-3,20-dione ChEBI ID CHEBI:16744 Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:26229, CHEBI:8383, CHEBI:14878 Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C21H28O2 Net Charge 0 Average Mass 312.44582 Monoisotopic Mass 312.20893 InChI InChI=1S/C21H28O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h9,12,16-18H,4-8,10-11H2,1-3H3/t16-,17+,18-,20-,21+/m0/s1 InChIKey LCXMRSLFWMMCAS-WRJHFWDFSA-N SMILES [H][C@@]12CCC3=CC(=O)CC[C@]3(C)C1=CC[C@]1(C)[C@H](CC[C@@]21[H])C(C)=O ChEBI Ontology Outgoing pregna-4,9(11)-diene-3,20-dione (CHEBI:16744) has parent hydride pregnane (CHEBI:8386) pregna-4,9(11)-diene-3,20-dione (CHEBI:16744) is a 20-oxo steroid (CHEBI:36885) pregna-4,9(11)-diene-3,20-dione (CHEBI:16744) is a 3-oxo-Δ4 steroid (CHEBI:47909) pregna-4,9(11)-diene-3,20-dione (CHEBI:16744) is a C21-steroid (CHEBI:61313) IUPAC Name pregna-4,9(11)-diene-3,20-dione Synonyms Sources Pregna-4,9(11)-diene-3,20-dione KEGG COMPOUND pregna-4,9(11)-diene-3,20-dione UniProt Manual Xref Database C04084 KEGG COMPOUND View more database links Last Modified 13 November 2017