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

Preferred term

xeromphalinone f  

Type

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

Broader concept

charge

  • 0

formula

  • C29H36O6

inchi

  • InChI=1S/C29H36O6/c1-14-22(31)23-28(35-23)9-16-7-26(4,5)11-19(16)29(14,28)24(32)34-13-18-20(30)12-27(33)8-15-6-25(2,3)10-17(15)21(18)27/h15-17,19,23,33H,1,6-13H2,2-5H3/t15-,16-,17-,19-,23-,27-,28-,29+/m1/s1

inchikey

  • PBSWJQCHCOJAFD-WZMYRWFZSA-N

mass

  • 480.601

monoisotopicmass

  • 480.25119

smiles

  • O=C1C(=C)[C@@]2(C(=O)OCC3=C4[C@@](O)(C[C@@H]5[C@H]4CC(C)(C)C5)CC3=O)[C@H]6[C@H](CC(C6)(C)C)C[C@]72[C@@H]1O7

subset

  • 2_STAR

synonym EXACT

  • [(3bR,6aR,7aR)-7a-hydroxy-5,5-dimethyl-2-oxo-1,3b,4,6,6a,7-hexahydrocyclopenta[a]pentalen-3-yl]methyl (1S,3R,7R,8S,11S)-5,5-dimethyl-9-methylidene-10-oxo-12-oxatetracyclo[6.4.0.01,11.03,7]dodecane-8-carboxylate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:217520

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