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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 > lipid > fatty acid derivative > icosanoid > prostanoid > mangiterpene a

Preferred term

mangiterpene a  

Type

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

Broader concept

charge

  • 0

formula

  • C22H30O6

inchi

  • InChI=1S/C22H30O6/c1-11(2)7-15-17-12(3)13-5-6-19(4,24)14(13)8-21(17)18(23)20(25)9-16(27-10-20)22(21,26)28-15/h7,13-17,24-26H,3,5-6,8-10H2,1-2,4H3/t13-,14-,15+,16-,17+,19+,20+,21+,22-/m0/s1

inchikey

  • ZXDDQDRWZPTJAA-MYIZHNDYSA-N

mass

  • 390.476

monoisotopicmass

  • 390.20424

smiles

  • O=C1[C@]23[C@](O[C@@H]([C@H]2C(=C)[C@@H]4CC[C@]([C@H]4C3)(O)C)C=C(C)C)(O)[C@@H]5C[C@@]1(O)CO5

subset

  • 2_STAR

synonym EXACT

  • (1S,2R,4R,5S,7R,10R,11S,13R,15R)-2,10,15-trihydroxy-10-methyl-6-methylidene-4-(2-methylprop-1-enyl)-3,17-dioxapentacyclo[13.2.1.02,13.05,13.07,11]octadecan-14-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:227757

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