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Concept information

organooxygen compound > napyradiomycin b2

Preferred term

napyradiomycin b2  

Type

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

charge

  • 0

formula

  • C25H28Cl2O5

inchi

  • InChI=1S/C25H28Cl2O5/c1-12-6-7-18(26)23(2,3)16(12)11-25-15(10-19(27)24(4,5)32-25)21(30)20-14(22(25)31)8-13(28)9-17(20)29/h8-10,16,18-19,28-29H,1,6-7,11H2,2-5H3/t16-,18+,19-,25-/m1/s1

inchikey

  • IJSYJQMXPZXWNA-PMEUVPMPSA-N

mass

  • 479.390

monoisotopicmass

  • 478.13138

smiles

  • Cl[C@@H]1C=C2C(=O)C3=C(O)C=C(O)C=C3C([C@]2(C[C@@H]4C(=C)CC[C@@H](C4(C)C)Cl)OC1(C)C)=O

subset

  • 2_STAR

synonym EXACT

  • (3R,10aR)-3-chloro-10a-[[(1R,3S)-3-chloro-2,2-dimethyl-6-methylidenecyclohexyl]methyl]-6,8-dihydroxy-2,2-dimethyl-3H-benzo[g]chromene-5,10-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:212630

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