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Concept information

organooxygen compound > cochleamycin b2

Preferred term

cochleamycin b2  

Type

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

charge

  • 0

formula

  • C23H30O5

inchi

  • InChI=1S/C23H30O5/c1-11(2)21(25)28-20-12(3)6-17-16(20)5-4-13-7-14-8-15-9-19(24)23(14,10-18(13)17)22(26)27-15/h4-5,11-18,20H,6-10H2,1-3H3/t12-,13+,14?,15+,16-,17-,18-,20-,23-/m1/s1

inchikey

  • WSWQMVNLCCKQMH-LACBXEJHSA-N

mass

  • 386.488

monoisotopicmass

  • 386.20932

smiles

  • O=C1O[C@@H]2CC([C@@]13C(C[C@@H]4C=C[C@@H]5[C@H]([C@@H]4C3)C[C@@H](C)[C@H]5OC(=O)C(C)C)C2)=O

subset

  • 2_STAR

synonym EXACT

  • [(1R,3R,4S,6R,7R,8R,11R,15S)-6-methyl-17,18-dioxo-16-oxapentacyclo[13.2.2.01,13.03,11.04,8]nonadec-9-en-7-yl] 2-methylpropanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:209140

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