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

Preferred term

antrodin a  

Type

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

Broader concept

charge

  • 0

formula

  • C15H22O3

inchi

  • InChI=1S/C15H22O3/c1-8-5-11(16)14(4)12(17)9-6-13(2,3)7-10(9)15(8,14)18/h5,9-10,12,17-18H,6-7H2,1-4H3/t9-,10+,12-,14+,15+/m0/s1

inchikey

  • UGBJNLYKOBXVAD-BKNSQDEOSA-N

mass

  • 250.338

monoisotopicmass

  • 250.15689

smiles

  • O=C1C=C(C)[C@@]2([C@]1([C@@H](O)[C@H]3CC(C[C@@H]23)(C)C)C)O

subset

  • 2_STAR

synonym EXACT

  • (3aS,3bR,6aS,7S,7aR)-3a,7-dihydroxy-3,5,5,7a-tetramethyl-4,6,6a,7-tetrahydro-3bH-cyclopenta[a]pentalen-1-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:198241

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