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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 > 5alpha,8alpha-epidioxy-23-methyl-(22e,24r)-ergosta-6,22-dien-3beta-ol
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > ergostanoid > 5alpha,8alpha-epidioxy-23-methyl-(22e,24r)-ergosta-6,22-dien-3beta-ol
... > 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 > 5alpha,8alpha-epidioxy-23-methyl-(22e,24r)-ergosta-6,22-dien-3beta-ol
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > ergostanoid > 5alpha,8alpha-epidioxy-23-methyl-(22e,24r)-ergosta-6,22-dien-3beta-ol
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > ergostanoid > 5alpha,8alpha-epidioxy-23-methyl-(22e,24r)-ergosta-6,22-dien-3beta-ol

Preferred term

5alpha,8alpha-epidioxy-23-methyl-(22e,24r)-ergosta-6,22-dien-3beta-ol  

Type

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

Broader concept

charge

  • 0

formula

  • C29H46O3

inchi

  • InChI=1S/C29H46O3/c1-18(2)21(5)19(3)16-20(4)23-8-9-24-26(23,6)12-11-25-27(7)13-10-22(30)17-28(27)14-15-29(24,25)32-31-28/h14-16,18,20-25,30H,8-13,17H2,1-7H3/b19-16+/t20-,21-,22+,23?,24?,25?,26-,27-,28-,29+/m1/s1

inchikey

  • BEFYGZGLHDYVIF-DPXMGVADSA-N

mass

  • 442.684

monoisotopicmass

  • 442.34470

smiles

  • O1O[C@@]23C=C[C@]14C(CC[C@]5(C4CCC5[C@@H](/C=C(/[C@@H](C(C)C)C)/C)C)C)[C@]2(CC[C@@H](C3)O)C

subset

  • 2_STAR

synonym EXACT

  • (1S,6R,10R,13S,15S)-6,10-dimethyl-5-[(E,2R,5R)-4,5,6-trimethylhept-3-en-2-yl]-16,17-dioxapentacyclo[13.2.2.01,9.02,6.010,15]nonadec-18-en-13-ol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:219014

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