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Concept information

Preferred term

3-dechloro-3-brominapyradiomycin a1  

Type

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

Broader concept

charge

  • 0

formula

  • C25H30BrClO5

inchi

  • InChI=1S/C25H30BrClO5/c1-14(2)7-6-8-15(3)9-10-25-21(30)17-11-16(28)12-18(29)20(17)22(31)24(25,27)13-19(26)23(4,5)32-25/h7,9,11-12,19,28-29H,6,8,10,13H2,1-5H3/t19-,24+,25+/m1/s1

inchikey

  • RETCPPWIOCMJEO-NGXZDTIWSA-N

mass

  • 525.860

monoisotopicmass

  • 524.09651

smiles

  • Br[C@H]1C(O[C@@]2([C@](Cl)(C1)C(=O)C3=C(C2=O)C=C(O)C=C3O)CC=C(CCC=C(C)C)C)(C)C

subset

  • 2_STAR

synonym EXACT

  • (3R,4aR,10aS)-3-bromo-4a-chloro-10a-(3,7-dimethylocta-2,6-dienyl)-6,8-dihydroxy-2,2-dimethyl-3,4-dihydrobenzo[g]chromene-5,10-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:189253

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