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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 > 2beta,20alpha-dimethyltetrahymanol
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > triterpenoid > 2beta,20alpha-dimethyltetrahymanol

Preferred term

2beta,20alpha-dimethyltetrahymanol  

Type

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

Broader concept

charge

  • 0

formula

  • C32H56O

inchi

  • InChI=1S/C32H56O/c1-20-17-27(3,4)22-13-15-31(9)24(29(22,7)18-20)11-12-25-30(8)19-21(2)26(33)28(5,6)23(30)14-16-32(25,31)10/h20-26,33H,11-19H2,1-10H3/t20-,21+,22+,23+,24-,25-,26+,29+,30+,31-,32-/m1/s1

inchikey

  • IRRPBKNYCQPNRU-SDPCAQMASA-N

mass

  • 456.799

monoisotopicmass

  • 456.43312

smiles

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

subset

  • 2_STAR

synonym EXACT

  • (2S,3S,4aR,6aR,6aR,6bR,8aS,11R,12aS,14aR,14bR)-2,4,4,6a,6b,9,9,11,12a,14b-decamethyl-1,2,3,4a,5,6,6a,7,8,8a,10,11,12,13,14,14a-hexadecahydropicen-3-ol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:219578

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