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Chemistry, part 2

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Concept information

... > organooxygen compound > carbonyl compound > ketone > oxo steroid > 20-oxo steroid > nodulisporisteroid l
... > 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 > 20-oxo steroid > nodulisporisteroid l
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > oxo steroid > 20-oxo steroid > nodulisporisteroid l
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > steroid > oxo steroid > 20-oxo steroid > nodulisporisteroid l
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > oxo steroid > 20-oxo steroid > nodulisporisteroid l
... > 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 > 20-oxo steroid > nodulisporisteroid l
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > oxo steroid > 20-oxo steroid > nodulisporisteroid l
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > oxo steroid > 20-oxo steroid > nodulisporisteroid l

Preferred term

nodulisporisteroid l  

Type

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

Broader concept

charge

  • 0

formula

  • C22H32O5

inchi

  • InChI=1S/C22H32O5/c1-11(23)13-4-5-14-12-10-17(25)19-18(20(26)27)16(24)7-9-22(19,3)15(12)6-8-21(13,14)2/h13-14,16-19,24-25H,4-10H2,1-3H3,(H,26,27)/t13-,14+,16+,17-,18-,19+,21-,22-/m1/s1

inchikey

  • WQQALAOCZONREL-QNHGDDGMSA-N

mass

  • 376.493

monoisotopicmass

  • 376.22497

smiles

  • O=C(O)[C@H]1[C@H]2[C@@](C3=C([C@H]4[C@]([C@@H](C(=O)C)CC4)(C)CC3)C[C@H]2O)(CC[C@@H]1O)C

subset

  • 2_STAR

synonym EXACT

  • (3S,4S,5S,6R,10S,13S,14R,17S)-17-acetyl-3,6-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-4-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:198537

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