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Concept information

Preferred term

fredericamycin c  

Type

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

Broader concept

charge

  • 0

formula

  • C31H24O11

inchi

  • InChI=1S/C31H24O11/c1-3-4-5-6-14(32)10-13-9-12-7-8-15-20(18(12)27(36)19(13)31(40)41)28(37)24-23(25(15)34)30(39)22-21(29(24)38)16(33)11-17(42-2)26(22)35/h3-6,9,11,33-37H,7-8,10H2,1-2H3,(H,40,41)/b4-3+,6-5+

inchikey

  • LKUAAWSFMBXAPQ-VNKDHWASSA-N

mass

  • 572.522

monoisotopicmass

  • 572.13186

smiles

  • O=C1C2=C(O)C3=C(C4=C(O)C(=C(CC(=O)/C=C/C=C/C)C=C4CC3)C(=O)O)C(=C2C(=O)C=5C1=C(O)C(OC)=CC5O)O

subset

  • 2_STAR

synonym EXACT

  • 1,7,9,12,14-pentahydroxy-10-methoxy-8,13-dioxo-3-[(3E,5E)-2-oxohepta-3,5-dienyl]-5,6-dihydrobenzo[a]tetracene-2-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:220595

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