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Concept information

Preferred term

minabeolide 5  

Type

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

charge

  • 0

formula

  • C29H40O5

inchi

  • InChI=1S/C29H40O5/c1-17-5-10-26(34-27(17)32)18(2)23-8-9-25-22-7-6-20-15-21(31)11-13-28(20,4)24(22)12-14-29(23,25)16-33-19(3)30/h11,13,15,17-18,22-26H,5-10,12,14,16H2,1-4H3/t17-,18-,22+,23+,24-,25-,26+,28-,29-/m0/s1

inchikey

  • KMDRJFYWGCLAGL-NXAGNEQWSA-N

mass

  • 468.62490

monoisotopicmass

  • 468.28757

smiles

  • [H][C@@]1(CC[C@@]2([H])[C@]3([H])CCC4=CC(=O)C=C[C@]4(C)[C@@]3([H])CC[C@]12COC(C)=O)[C@H](C)[C@H]1CC[C@H](C)C(=O)O1

subset

  • 3_STAR

synonym EXACT

  • (22R,25S)-3,26-dioxo-22,26-epoxycholesta-1,4-dien-18-yl acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:67569

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