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Chemistry, part 2

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Concept information

organooxygen compound > carbonyl compound > ketone > oxo steroid > 17beta-hydroxy-4-oxa-5alpha-androst-1-en-3-one acetate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > ketone > oxo steroid > 17beta-hydroxy-4-oxa-5alpha-androst-1-en-3-one acetate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > oxo steroid > 17beta-hydroxy-4-oxa-5alpha-androst-1-en-3-one acetate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > steroid > oxo steroid > 17beta-hydroxy-4-oxa-5alpha-androst-1-en-3-one acetate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > oxo steroid > 17beta-hydroxy-4-oxa-5alpha-androst-1-en-3-one acetate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > oxo steroid > 17beta-hydroxy-4-oxa-5alpha-androst-1-en-3-one acetate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > oxo steroid > 17beta-hydroxy-4-oxa-5alpha-androst-1-en-3-one acetate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > oxo steroid > 17beta-hydroxy-4-oxa-5alpha-androst-1-en-3-one acetate

Preferred term

17beta-hydroxy-4-oxa-5alpha-androst-1-en-3-one acetate  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C20H28O4

inchi

  • InChI=1S/C20H28O4/c1-12(21)23-16-7-5-14-13-4-6-17-20(3,11-9-18(22)24-17)15(13)8-10-19(14,16)2/h9,11,13-17H,4-8,10H2,1-3H3/t13-,14-,15-,16-,17+,19-,20+/m0/s1

inchikey

  • NJHXENDODLZLSB-SHUFMVBLSA-N

mass

  • 332.43390

monoisotopicmass

  • 332.19876

smiles

  • CC(=O)O[C@H]1CC[C@H]2[C@@H]3CC[C@H]4OC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:79588

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