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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 > terpene lactone > ircinolin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > terpene lactone > ircinolin a
... > organooxygen compound > ester > carboxylic ester > lactone > terpene lactone > ircinolin a
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > terpene lactone > ircinolin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > terpene lactone > ircinolin a
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > terpene lactone > ircinolin a
organooxygen compound > ester > lactone > terpene lactone > ircinolin a
organooxygen compound > oxacycle > lactone > terpene lactone > ircinolin a
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > terpene lactone > ircinolin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > terpene lactone > ircinolin a
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > terpene lactone > ircinolin a

Preferred term

ircinolin a  

Type

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

Broader concept

charge

  • 0

formula

  • C21H34O6

has_role

inchi

  • InChI=1S/C21H34O6/c1-15(6-4-5-7-17(23)14-22)12-18(24)13-16(2)8-9-19(25)21(3)11-10-20(26)27-21/h6,13,18-19,22,24-25H,4-5,7-12,14H2,1-3H3/b15-6+,16-13+/t18-,19+,21-/m0/s1

inchikey

  • YKUZFPGHZVFVLY-DZMSUEBXSA-N

mass

  • 382.49110

monoisotopicmass

  • 382.23554

smiles

  • C/C(CC[C@@H](O)[C@]1(C)CCC(=O)O1)=C/[C@@H](O)C/C(C)=C/CCCC(=O)CO

subset

  • 2_STAR

synonym RELATED

  • (5S)-5-Methyl-5-[(1R,4E,6S,8E)-1,6,14-trihydroxy-4,8-dimethyl-13-oxo-4,8-tetradecadien-1-yl]dihydro-2(3H)-furanone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:69461

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