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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 > rubetaulanobiline 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 > rubetaulanobiline a
... > organooxygen compound > ester > carboxylic ester > lactone > terpene lactone > rubetaulanobiline a
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > terpene lactone > rubetaulanobiline 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 > rubetaulanobiline a
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > terpene lactone > rubetaulanobiline a
organooxygen compound > ester > lactone > terpene lactone > rubetaulanobiline a
organooxygen compound > oxacycle > lactone > terpene lactone > rubetaulanobiline a
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > terpene lactone > rubetaulanobiline 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 > rubetaulanobiline a
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > terpene lactone > rubetaulanobiline a

Preferred term

rubetaulanobiline a  

Type

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

Broader concept

charge

  • 0

formula

  • C15H20O3

inchi

  • InChI=1S/C15H20O3/c1-9-4-11-10(7-18-13(11)16)5-15(17)8-14(2,3)6-12(9)15/h4-5,9,12,17H,6-8H2,1-3H3/t9-,12+,15-/m0/s1

inchikey

  • IVRYPTRDQJCUFA-UAKXVISKSA-N

mass

  • 248.322

monoisotopicmass

  • 248.14124

smiles

  • O=C1OCC=2C1=C[C@@H]([C@H]3CC(C[C@]3(C2)O)(C)C)C

subset

  • 2_STAR

synonym EXACT

  • (5S,5aR,8aS)-8a-hydroxy-5,7,7-trimethyl-5,5a,6,8-tetrahydro-1H-azuleno[5,6-c]uran-3-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:211503

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