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Chemistry, part 2

Content language

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Concept information

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

Preferred term

nisterime acetate  

Type

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

Broader concept

charge

  • 0

formula

  • C27H35ClN2O5

inchi

  • InChI=1S/C27H35ClN2O5/c1-16(31)34-25-11-10-21-20-9-4-17-14-24(29-35-19-7-5-18(6-8-19)30(32)33)23(28)15-27(17,3)22(20)12-13-26(21,25)2/h5-8,17,20-23,25H,4,9-15H2,1-3H3/b29-24-/t17-,20-,21-,22-,23+,25-,26-,27-/m0/s1

inchikey

  • NNFGKFKPLQYECP-BYXNGVTISA-N

mass

  • 503.040

monoisotopicmass

  • 502.22345

smiles

  • Cl[C@@H]/1C[C@@]2([C@@]3([C@]([C@]4([C@](CC3)([C@@H](OC(=O)C)CC4)C)[H])(CC[C@]2(C/C1=N/OC5=CC=C([N+]([O-])=O)C=C5)[H])[H])[H])C

subset

  • 2_STAR

synonym EXACT

  • [(2R,3Z,5S,8R,9S,10S,13S,14S,17S)-2-chloro-10,13-dimethyl-3-(4-nitrophenoxy)imino-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:177572

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