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Concept information

3beta-hydroxy steroid > 4,4-dimethyl-14alpha-formyl-5alpha-cholesta-8,24-dien-3beta,15alpha-diol
... > organooxygen compound > carbonyl compound > aldehyde > steroid aldehyde > 14-formyl steroid > 14alpha-formyl steroid > 4,4-dimethyl-14alpha-formyl-5alpha-cholesta-8,24-dien-3beta,15alpha-diol

Preferred term

4,4-dimethyl-14alpha-formyl-5alpha-cholesta-8,24-dien-3beta,15alpha-diol  

Type

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

charge

  • 0

formula

  • C30H48O3

inchi

  • InChI=1S/C30H48O3/c1-19(2)9-8-10-20(3)23-17-26(33)30(18-31)22-11-12-24-27(4,5)25(32)14-15-28(24,6)21(22)13-16-29(23,30)7/h9,18,20,23-26,32-33H,8,10-17H2,1-7H3/t20-,23-,24+,25+,26+,28-,29-,30-/m1/s1

inchikey

  • SFAFFKXDWJHUSZ-SSORVZQWSA-N

mass

  • 456.711

monoisotopicmass

  • 456.36035

smiles

  • O[C@@H]1C([C@]2([C@@](C3=C([C@]4([C@@]([C@](C[C@@H]4O)([C@@H](CCC=C(C)C)C)[H])(CC3)C)C=O)CC2)(CC1)C)[H])(C)C

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:144025

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