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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 > olean-12-ene-3,16,22,28-tetrol
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > triterpenoid > olean-12-ene-3,16,22,28-tetrol

Preferred term

olean-12-ene-3,16,22,28-tetrol  

Type

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

Broader concept

charge

  • 0

formula

  • C30H50O4

inchi

  • InChI=1S/C30H50O4/c1-25(2)14-19-18-8-9-21-27(5)12-11-22(32)26(3,4)20(27)10-13-28(21,6)29(18,7)16-24(34)30(19,17-31)23(33)15-25/h8,19-24,31-34H,9-17H2,1-7H3/t19-,20?,21-,22+,23+,24-,27+,28-,29-,30-/m1/s1

inchikey

  • CTNHZEZBBGIUJB-YSRXEMINSA-N

mass

  • 474.726

monoisotopicmass

  • 474.37091

smiles

  • O[C@H]1[C@@]2([C@@](C=3[C@]([C@]4([C@@]([C@@]5(C(CC4)C([C@@H](O)CC5)(C)C)C)(CC3)[H])C)(C1)C)(CC(C[C@@H]2O)(C)C)[H])CO

subset

  • 2_STAR

synonym EXACT

  • (3S,6aR,6bS,8R,8aS,9S,12aR,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-3,8,9-triol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:176765

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