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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 > sesquiterpenoid > antrodin d
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > sesquiterpenoid > antrodin d

Preferred term

antrodin d  

Type

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

Broader concept

charge

  • 0

formula

  • C16H28O

inchi

  • InChI=1S/C16H28O/c1-9-6-12-14(17)11-7-15(3,4)8-13(11)16(12,5)10(9)2/h9-14,17H,6-8H2,1-5H3/t9-,10-,11-,12-,13+,14-,16+/m0/s1

inchikey

  • JXTINQFFOKAJPL-CVEYVTCZSA-N

mass

  • 236.399

monoisotopicmass

  • 236.21402

smiles

  • O[C@@H]1[C@H]2[C@]([C@@H](C)[C@H](C2)C)(C)[C@H]3[C@@H]1CC(C)(C)C3

subset

  • 2_STAR

synonym EXACT

  • (2S,3S,3aS,3bR,6aS,7S,7aR)-2,3,3a,5,5-pentamethyl-2,3,3b,4,6,6a,7,7a-octahydro-1H-cyclopenta[a]pentalen-7-ol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:201352

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