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Chemistry, part 2

Content language

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Concept information

organooxygen compound > ester > steroid ester > ximaosteroid b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > steroid > steroid ester > ximaosteroid b
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > steroid ester > ximaosteroid b
... > 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 > steroid ester > ximaosteroid b
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > steroid ester > ximaosteroid b
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > steroid ester > ximaosteroid b

Preferred term

ximaosteroid b  

Type

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

Broader concept

charge

  • 0

formula

  • C26H40O3

inchi

  • InChI=1S/C26H40O3/c1-6-19-7-8-22-21-14-18(13-16(2)27)24-15-20(29-17(3)28)9-11-26(24,5)23(21)10-12-25(19,22)4/h6,18-24H,1,7-15H2,2-5H3/t18-,19-,20-,21-,22-,23-,24+,25+,26+/m0/s1

inchikey

  • WCCDJKJOBCIYJT-SMKAPGMPSA-N

mass

  • 400.603

monoisotopicmass

  • 400.29775

smiles

  • O([C@@H]1C[C@]2([C@@]([C@@]3([C@]([C@]4([C@](CC3)([C@H](CC4)C=C)C)[H])(C[C@@H]2CC(=O)C)[H])[H])(CC1)C)[H])C(=O)C

subset

  • 2_STAR

synonym EXACT

  • [(3S,5R,6R,8S,9S,10S,13R,14S,17R)-17-ethenyl-10,13-dimethyl-6-(2-oxopropyl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:183047

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