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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 > 1,10,11,12-guaianetetrol
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > sesquiterpenoid > 1,10,11,12-guaianetetrol

Preferred term

1,10,11,12-guaianetetrol  

Type

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

Broader concept

charge

  • 0

formula

  • C15H28O7S

inchi

  • InChI=1S/C15H28O7S/c1-10-4-7-15(18)12(10)8-11(5-6-14(15,3)17)13(2,16)9-22-23(19,20)21/h10-12,16-18H,4-9H2,1-3H3,(H,19,20,21)/t10-,11+,12-,13?,14+,15?/m0/s1

inchikey

  • WGZJGSMZQTWTSO-NIBQUVFZSA-N

mass

  • 352.440

monoisotopicmass

  • 352.15557

smiles

  • S(=O)(=O)(OCC(O)([C@H]1C[C@@H]2C(O)(CC[C@@H]2C)[C@@](CC1)(O)C)C)O

subset

  • 2_STAR

synonym EXACT

  • [2-[(3S,3aS,5R,8R)-8,8a-dihydroxy-3,8-dimethyl-1,2,3,3a,4,5,6,7-octahydroazulen-5-yl]-2-hydroxypropyl] hydrogen sulate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:213070

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