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Chemistry, part 2

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > steroid > cholestanoid > cholesta-5,7,8(14),22e-tetraen-3-one
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > cholestanoid > cholesta-5,7,8(14),22e-tetraen-3-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 > cholestanoid > cholesta-5,7,8(14),22e-tetraen-3-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > cholestanoid > cholesta-5,7,8(14),22e-tetraen-3-one
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > cholestanoid > cholesta-5,7,8(14),22e-tetraen-3-one

Preferred term

cholesta-5,7,8(14),22e-tetraen-3-one  

Type

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

Broader concept

charge

  • 0

formula

  • C27H38O

inchi

  • InChI=1S/C27H38O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h6,8-10,17-19,23,25H,7,11-16H2,1-5H3/b8-6+/t19-,23-,25+,26+,27-/m1/s1

inchikey

  • AJRNPFZYKICTEM-AQAVSRJYSA-N

mass

  • 378.600

monoisotopicmass

  • 378.29227

smiles

  • O=C1CC[C@@]2([C@]3(CC[C@@]4([C@](CCC4=C3C=CC2=C1)([C@H](C)/C=C/CC(C)C)[H])C)[H])C

subset

  • 2_STAR

synonym EXACT

  • (9R,10R,13R,17R)-10,13-dimethyl-17-[(E,2R)-6-methylhept-3-en-2-yl]-1,2,9,11,12,15,16,17-octahydrocyclopenta[a]phenanthren-3-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:185963

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