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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 > diterpenoid > fornicatin e
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > diterpenoid > fornicatin e

Preferred term

fornicatin e  

Type

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

Broader concept

charge

  • 0

formula

  • C28H42O6

inchi

  • InChI=1S/C28H42O6/c1-16(2)19-14-20(29)25-24(26(19,4)12-11-22(31)32)21(30)15-28(6)18(10-13-27(25,28)5)17(3)8-9-23(33)34-7/h17-20,29H,1,8-15H2,2-7H3,(H,31,32)/t17-,18-,19?,20+,26+,27+,28-/m1/s1

inchikey

  • XXRAHMQIWCNBKA-XZFWSZNQSA-N

mass

  • 474.638

monoisotopicmass

  • 474.29814

smiles

  • O=C1C2=C([C@@]3(CC[C@@H]([C@]3(C1)C)[C@@H](CCC(=O)OC)C)C)[C@@H](O)CC([C@@]2(CCC(=O)O)C)C(=C)C

subset

  • 2_STAR

synonym EXACT

  • 3-[(3R,3aR,6S,9S,9bR)-9-hydroxy-3-[(2R)-5-methoxy-5-oxopentan-2-yl]-3a,6,9b-trimethyl-5-oxo-7-prop-1-en-2-yl-2,3,4,7,8,9-hexahydro-1H-cyclopenta[a]naphthalen-6-yl]propanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:220182

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