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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 > pf1092a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > terpene lactone > pf1092a
... > organooxygen compound > ester > carboxylic ester > lactone > terpene lactone > pf1092a
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > terpene lactone > pf1092a
... > 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 > pf1092a
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > terpene lactone > pf1092a
organooxygen compound > ester > lactone > terpene lactone > pf1092a
organooxygen compound > oxacycle > lactone > terpene lactone > pf1092a
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > terpene lactone > pf1092a
... > 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 > pf1092a
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > terpene lactone > pf1092a

Preferred term

pf1092a  

Type

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

Broader concept

charge

  • 0

formula

  • C17H20O5

inchi

  • InChI=1S/C17H20O5/c1-8-12-7-17(4)9(2)15(21-10(3)18)13(19)5-11(17)6-14(12)22-16(8)20/h5-6,9,13,15,19H,7H2,1-4H3/t9-,13-,15+,17+/m0/s1

inchikey

  • BVVRFLKHDORYLD-SSLUWCKPSA-N

mass

  • 304.342

monoisotopicmass

  • 304.13107

smiles

  • O=C1OC2=CC3=C[C@H](O)[C@@H]([C@@H]([C@]3(CC2=C1C)C)C)OC(=O)C

subset

  • 2_STAR

synonym EXACT

  • [(4aR,5R,6R,7S)-7-hydroxy-3,4a,5-trimethyl-2-oxo-4,5,6,7-tetrahydrobenzo[][1]benzouran-6-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:201021

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