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

Preferred term

hydratopyrrhoxanthinol  

Type

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

Broader concept

charge

  • 0

formula

  • C37H48O6

inchi

  • InChI=1S/C37H48O6/c1-25(15-16-32-27(3)20-29(38)22-34(32,4)5)13-11-9-10-12-14-26(2)19-31-21-28(33(40)43-31)17-18-37(42)35(6,7)23-30(39)24-36(37,8)41/h9-14,17-19,21,29-30,38-39,41-42H,20,22-24H2,1-8H3/b11-9+,12-10-,18-17+,25-13-,26-14+,31-19+

inchikey

  • NKLWCOIOKXMOKC-FSEXIHCTSA-N

mass

  • 588.785

monoisotopicmass

  • 588.34509

smiles

  • OC1(C(CC(O)CC1(O)C)(C)C)/C=C/C2=C/C(/OC2=O)=C/C(/C)=C/C=C/C=C/C=C(/C#CC=3C(CC(O)CC3C)(C)C)/C

subset

  • 2_STAR

synonym EXACT

  • (5E)-5-[(2E,4Z,6E,8Z)-11-(4-hydroxy-2,6,6-trimethylcyclohexen-1-yl)-2,9-dimethylundeca-2,4,6,8-tetraen-10-ynylidene]-3-[(E)-2-(1,2,4-trihydroxy-2,6,6-trimethylcyclohexyl)ethenyl]uran-2-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:176155

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