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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 > 3-o-ethyl-lactarorufin 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 > 3-o-ethyl-lactarorufin a
... > organooxygen compound > ester > carboxylic ester > lactone > terpene lactone > 3-o-ethyl-lactarorufin a
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > terpene lactone > 3-o-ethyl-lactarorufin 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 > 3-o-ethyl-lactarorufin a
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > terpene lactone > 3-o-ethyl-lactarorufin a
organooxygen compound > ester > lactone > terpene lactone > 3-o-ethyl-lactarorufin a
organooxygen compound > oxacycle > lactone > terpene lactone > 3-o-ethyl-lactarorufin a
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > terpene lactone > 3-o-ethyl-lactarorufin 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 > 3-o-ethyl-lactarorufin a
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > terpene lactone > 3-o-ethyl-lactarorufin a

Preferred term

3-o-ethyl-lactarorufin a  

Type

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

Broader concept

charge

  • 0

formula

  • C17H26O4

inchi

  • InChI=1S/C17H26O4/c1-5-21-17(4)7-10-12(9-20-15(10)19)14(18)11-6-16(2,3)8-13(11)17/h11,13-14,18H,5-9H2,1-4H3/t11-,13+,14+,17+/m1/s1

inchikey

  • CPIWQHDTPYKJDN-YSLLHCQFSA-N

mass

  • 294.391

monoisotopicmass

  • 294.18311

smiles

  • O=C1OCC2=C1C[C@](OCC)([C@H]3CC(C[C@H]3[C@@H]2O)(C)C)C

subset

  • 2_STAR

synonym EXACT

  • (5S,5aS,8aR,9S)-5-ethoxy-9-hydroxy-5,7,7-trimethyl-4,5a,6,8,8a,9-hexahydro-1H-azuleno[5,6-c]uran-3-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:201846

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