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Concept information

organooxygen compound > oxacycle > furans > butenolide > aglaiabbreviatin a

Preferred term

aglaiabbreviatin a  

Type

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

charge

  • 0

formula

  • C27H40O3

inchi

  • InChI=1S/C27H40O3/c1-23(2)19-10-15-26(5)20(24(19,3)13-11-21(23)28)8-7-17-18(9-14-25(17,26)4)27(6)16-12-22(29)30-27/h12,16-20H,7-11,13-15H2,1-6H3/t17-,18+,19+,20-,24+,25-,26-,27+/m1/s1

inchikey

  • JRGYNXKJYVLQBR-QPBHWVAKSA-N

mass

  • 412.60470

monoisotopicmass

  • 412.29775

smiles

  • C[C@@]1(OC(=O)C=C1)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CCC(=O)C(C)(C)[C@@H]3CC[C@@]21C

subset

  • 3_STAR

synonym EXACT

  • rel-(5alpha)-4,4,8,14-tetramethyl-20,24-epoxy-18-norchol-22-ene-3,24-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:70262

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