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Chemistry, part 2

Content language

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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 > isoprenoid > terpenoid > triterpenoid > 22alpha-hydroxyerythrodiol
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > triterpenoid > 22alpha-hydroxyerythrodiol

Preferred term

22alpha-hydroxyerythrodiol  

Type

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

Broader concept

charge

  • 0

formula

  • C30H50O3

inchi

  • InChI=1S/C30H50O3/c1-25(2)16-20-19-8-9-22-27(5)12-11-23(32)26(3,4)21(27)10-13-29(22,7)28(19,6)14-15-30(20,18-31)24(33)17-25/h8,20-24,31-33H,9-18H2,1-7H3/t20-,21-,22+,23-,24-,27-,28+,29+,30-/m0/s1

inchikey

  • YXTURDGNXCWFHX-NEPODAOMSA-N

mass

  • 458.727

monoisotopicmass

  • 458.37600

smiles

  • O[C@@H]1C([C@]2([C@@]([C@@]3([C@]([C@]4(C([C@]5([C@@](CC4)([C@@H](O)CC(C5)(C)C)CO)[H])=CC3)C)(CC2)C)[H])(CC1)C)[H])(C)C

subset

  • 2_STAR

synonym EXACT

  • (3S,4aR,6aR,6bS,8aR,9S,12aS,14aR,14bR)-8a-(hydroxymethyl)-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-3,9-diol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:191761

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