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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 > triterpenoid > meliasenin j, rel-
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > triterpenoid > meliasenin j, rel-

Preferred term

meliasenin j, rel-  

Type

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

Broader concept

charge

  • 0

formula

  • C30H48O4

has_role

inchi

  • InChI=1S/C30H48O4/c1-19(10-9-15-26(2,3)34-33)25-22(31)18-30(8)21-11-12-23-27(4,5)24(32)14-16-28(23,6)20(21)13-17-29(25,30)7/h9,11,15,19-20,22-23,25,31,33H,10,12-14,16-18H2,1-8H3/b15-9+/t19-,20+,22+,23+,25-,28-,29+,30-/m1/s1

inchikey

  • KXEPOJYGPBBQJS-LKJGIETFSA-N

mass

  • 472.69970

monoisotopicmass

  • 472.35526

smiles

  • [H][C@]12CC[C@@]3(C)[C@]([H])([C@H](C)C/C=C/C(C)(C)OO)[C@@H](O)C[C@]3(C)C1=CC[C@@]1([H])C(C)(C)C(=O)CC[C@]21C

subset

  • 2_STAR

synonym RELATED

  • rel-(20R,23E)-25-hydroperoxyeupha-7,23-dien-16beta-ol-3-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:70518

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