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Concept information

organooxygen compound > oxacycle > pyrans > pyranone > macquarimicin b

Preferred term

macquarimicin b  

Type

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

Broader concept

charge

  • 0

formula

  • C22H28O6

inchi

  • InChI=1S/C22H28O6/c1-10-5-16-15(21(10)26)4-3-12-7-13(24)8-14-9-18(25)20(22(27)28-14)17(19(12)16)6-11(2)23/h3-4,10,12-17,19,24-25H,5-9H2,1-2H3/t10-,12-,13-,14-,15+,16+,17+,19+/m1/s1

inchikey

  • MLTKAVZDJLQPHH-OKLWPZDHSA-N

mass

  • 388.460

monoisotopicmass

  • 388.18859

smiles

  • O=C1O[C@@H]2C[C@H](O)C[C@@H]3[C@H]([C@@H](C1=C(O)C2)CC(=O)C)[C@@H]4[C@@H](C(=O)[C@@H](C4)C)C=C3

subset

  • 2_STAR

synonym EXACT

  • (2S,3S,4R,6R,8S,11S,13R,15R)-13,18-dihydroxy-6-methyl-2-(2-oxopropyl)-16-oxatetracyclo[13.2.2.03,11.04,8]nonadeca-1(18),9-diene-7,17-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:204429

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