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Concept information

organooxygen compound > ester > lactone > steroid lactone > hellebrigenin 3-acetate
organooxygen compound > oxacycle > lactone > steroid lactone > hellebrigenin 3-acetate

Preferred term

hellebrigenin 3-acetate  

Type

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

Broader concept

charge

  • 0

formula

  • C26H34O7

has_functional_parent

inchi

  • InChI=1S/C26H34O7/c1-16(28)33-18-5-10-24(15-27)20-6-9-23(2)19(17-3-4-22(29)32-14-17)8-12-26(23,31)21(20)7-11-25(24,30)13-18/h3-4,14-15,18-21,30-31H,5-13H2,1-2H3/t18-,19+,20-,21+,23+,24-,25-,26-/m0/s1

inchikey

  • VIOBLZMEZRNYRR-XDFZRXKSSA-N

mass

  • 458.545

monoisotopicmass

  • 458.23045

smiles

  • CC(=O)O[C@H]1CC[C@]2(C=O)[C@H]3CC[C@]4(C)[C@H](CC[C@]4(O)[C@@H]3CC[C@]2(O)C1)c1ccc(=O)oc1

subset

  • 2_STAR

synonym EXACT

  • Hellebrigenin 3-acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:5644

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