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Chemistry, part 2

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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 > ergostanoid > (22e)-ergosta-4,6,8(14),22,24(28)-pentaen-3-one
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > ergostanoid > (22e)-ergosta-4,6,8(14),22,24(28)-pentaen-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 > ergostanoid > (22e)-ergosta-4,6,8(14),22,24(28)-pentaen-3-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > ergostanoid > (22e)-ergosta-4,6,8(14),22,24(28)-pentaen-3-one
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > ergostanoid > (22e)-ergosta-4,6,8(14),22,24(28)-pentaen-3-one

Preferred term

(22e)-ergosta-4,6,8(14),22,24(28)-pentaen-3-one  

Type

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

Broader concept

charge

  • 0

formula

  • C28H38O

inchi

  • InChI=1S/C28H38O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-10,17-18,20,24,26H,3,11-16H2,1-2,4-6H3/b8-7+/t20-,24-,26+,27+,28-/m1/s1

inchikey

  • TVHXCCXWQYICOI-FCXPTMTQSA-N

mass

  • 390.611

monoisotopicmass

  • 390.29227

smiles

  • O=C1C=C2C=CC3=C4[C@]([C@@H]([C@@H](/C=C/C(=C)C(C)C)C)CC4)(C)CC[C@@H]3[C@@]2(C)CC1

subset

  • 2_STAR

synonym EXACT

  • (9R,10R,13R,17R)-10,13-dimethyl-17-[(E,2R)-6-methyl-5-methylidenehept-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:209134

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