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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 > isoprenoid > terpenoid > monoterpenoid > p-menthane monoterpenoid > isocadinanol a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > monoterpenoid > p-menthane monoterpenoid > isocadinanol a

Preferred term

isocadinanol a  

Type

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

Broader concept

charge

  • 0

formula

  • C15H26O3

inchi

  • InChI=1S/C15H26O3/c1-8(2)11-7-12(16)9(3)10-5-6-13(17)14(4)15(10,11)18-14/h8-13,16-17H,5-7H2,1-4H3/t9-,10+,11-,12-,13-,14-,15-/m1/s1

inchikey

  • KALHVLRQNHIJOX-CVEQBJKISA-N

mass

  • 254.370

monoisotopicmass

  • 254.18819

smiles

  • O1[C@]23[C@H]([C@H]([C@H](O)C[C@@H]2C(C)C)C)CC[C@H]([C@@]13C)O

subset

  • 2_STAR

synonym EXACT

  • (1aR,2R,4aS,5R,6R,8R,8aS)-1a,5-dimethyl-8-propan-2-yl-2,3,4,4a,5,6,7,8-octahydronaphtho[1,8a-b]oxirene-2,6-diol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:197781

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