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

Preferred term

inonoalliacane h  

Type

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

Broader concept

charge

  • 0

formula

  • C19H30O6

inchi

  • InChI=1S/C19H30O6/c1-9(2)15(23)24-16-17(5,6)7-12-11(4)13(21)14(22)18(10(3)8-20)19(12,16)25-18/h9,11-14,16,20-22H,3,7-8H2,1-2,4-6H3/t11-,12+,13-,14-,16-,18+,19+/m0/s1

inchikey

  • XSISFAKNZSTKFB-SXSFCFGSSA-N

mass

  • 354.443

monoisotopicmass

  • 354.20424

smiles

  • O=C(O[C@H]1C(C[C@H]2[C@@]13O[C@]3(C(=C)CO)[C@@H](O)[C@@H](O)[C@H]2C)(C)C)C(C)C

subset

  • 2_STAR

synonym EXACT

  • [(1R,3R,4S,5S,6S,7R,10S)-4,5-dihydroxy-3-(3-hydroxyprop-1-en-2-yl)-6,9,9-trimethyl-2-oxatricyclo[5.3.0.01,3]decan-10-yl] 2-methylpropanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:214625

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