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

Preferred term

inonoalliacane d  

Type

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

Broader concept

charge

  • 0

formula

  • C20H30O7

inchi

  • InChI=1S/C20H30O7/c1-9(2)13(22)16(25)26-17-18(5,6)7-12-11(4)14(23)15(24)19(10(3)8-21)20(12,17)27-19/h9,11-14,17,21-23H,3,7-8H2,1-2,4-6H3/t11-,12+,13?,14-,17-,19+,20+/m0/s1

inchikey

  • TYSMGDPIYYHWHH-WMHHHQFYSA-N

mass

  • 382.453

monoisotopicmass

  • 382.19915

smiles

  • O=C1[C@]2(O[C@]23[C@@H](OC(=O)C(O)C(C)C)C(C)(C)C[C@@H]3[C@@H]([C@@H]1O)C)C(=C)CO

subset

  • 2_STAR

synonym EXACT

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

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:214652

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