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Concept information

Preferred term

11-o-demethylpradimicinone ii  

Type

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

Broader concept

charge

  • 0

formula

  • C27H21NO12

inchi

  • InChI=1S/C27H21NO12/c1-6-3-9-14(21(33)12(6)26(38)28-7(2)27(39)40)15-16(25(37)20(9)32)24(36)18-17(23(15)35)19(31)10-4-8(29)5-11(30)13(10)22(18)34/h3-5,7,20,25,29-30,32-33,35-37H,1-2H3,(H,28,38)(H,39,40)/t7?,20-,25-/m0/s1

inchikey

  • ZYIREGFVRPWOMN-MAVRXOSISA-N

mass

  • 551.456

monoisotopicmass

  • 551.10638

smiles

  • CC(NC(=O)c1c(C)cc2[C@H](O)[C@@H](O)c3c(O)c4C(=O)c5c(O)cc(O)cc5C(=O)c4c(O)c3-c2c1O)C(O)=O

subset

  • 2_STAR

synonym EXACT

  • 11-O-Demethylpradimicinone II

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:722

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