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Chemistry, part 2

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Concept information

organooxygen compound > carbonyl compound > ketone > oxo steroid > 3b-hydroxy-estra-5,7,9-trien-17-one
... > 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 > 3b-hydroxy-estra-5,7,9-trien-17-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > oxo steroid > 3b-hydroxy-estra-5,7,9-trien-17-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > steroid > oxo steroid > 3b-hydroxy-estra-5,7,9-trien-17-one
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > oxo steroid > 3b-hydroxy-estra-5,7,9-trien-17-one
... > 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 > 3b-hydroxy-estra-5,7,9-trien-17-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > oxo steroid > 3b-hydroxy-estra-5,7,9-trien-17-one
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > oxo steroid > 3b-hydroxy-estra-5,7,9-trien-17-one

Preferred term

3b-hydroxy-estra-5,7,9-trien-17-one  

Type

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

Broader concept

charge

  • 0

formula

  • C18H22O2

inchi

  • InChI=1S/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h2,4,12,16,19H,3,5-10H2,1H3/t12?,16-,18-/m0/s1

inchikey

  • OMDIWOLGOMWKEH-YSAJCMGZSA-N

mass

  • 270.372

monoisotopicmass

  • 270.16198

smiles

  • O=C1[C@@]2([C@@H](CC1)C3=C(CC2)C4=C(CC(O)CC4)C=C3)C

subset

  • 2_STAR

synonym EXACT

  • (13S,14S)-3-hydroxy-13-methyl-2,3,4,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-17-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:230181

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