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Concept information

... > organooxygen compound > ester > carboxylic ester > lactone > gamma-lactone > butan-4-olide > 3-hydroxy-24,25,26,27-tetranortirucall-7-ene-23(21)-lactone
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > gamma-lactone > butan-4-olide > 3-hydroxy-24,25,26,27-tetranortirucall-7-ene-23(21)-lactone
... > organooxygen compound > ester > lactone > gamma-lactone > butan-4-olide > 3-hydroxy-24,25,26,27-tetranortirucall-7-ene-23(21)-lactone
... > organooxygen compound > oxacycle > lactone > gamma-lactone > butan-4-olide > 3-hydroxy-24,25,26,27-tetranortirucall-7-ene-23(21)-lactone
... > organooxygen compound > oxacycle > oxolanes > tetrahydrofuranone > butan-4-olide > 3-hydroxy-24,25,26,27-tetranortirucall-7-ene-23(21)-lactone

Preferred term

3-hydroxy-24,25,26,27-tetranortirucall-7-ene-23(21)-lactone  

Type

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

charge

  • 0

formula

  • C26H40O3

inchi

  • InChI=1S/C26H40O3/c1-23(2)20-7-6-19-18(24(20,3)11-10-21(23)27)9-13-25(4)17(8-12-26(19,25)5)16-14-22(28)29-15-16/h6,16-18,20-21,27H,7-15H2,1-5H3/t16-,17+,18+,20+,21-,24-,25+,26-/m1/s1

inchikey

  • JUXMUKOXQMUUKD-NGKMTSHWSA-N

mass

  • 400.59400

monoisotopicmass

  • 400.29775

smiles

  • C[C@@]12CC[C@H]3C(=CC[C@H]4C(C)(C)[C@H](O)CC[C@]34C)[C@@]1(C)CC[C@H]2C1COC(=O)C1

subset

  • 3_STAR

synonym EXACT

  • (3alpha,5alpha,13alpha,17alpha,20S)-3-hydroxy-4,4,14-trimethylcard-7-enolide

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:69010

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