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Chemistry, part 1

Content language

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Concept information

... > chemical entity > molecular entity > ion > anion > organic anion > novobiocin(1-)
... > chemical entity > molecular entity > ion > organic ion > organic anion > novobiocin(1-)
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic ion > organic anion > novobiocin(1-)

Preferred term

novobiocin(1-)  

Type

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

Broader concept

charge

  • -1

formula

  • C31H35N2O11

inchi

  • InChI=1S/C31H36N2O11/c1-14(2)7-8-16-13-17(9-11-19(16)34)27(37)33-21-22(35)18-10-12-20(15(3)24(18)42-28(21)38)41-29-23(36)25(43-30(32)39)26(40-6)31(4,5)44-29/h7,9-13,23,25-26,29,34-36H,8H2,1-6H3,(H2,32,39)(H,33,37)/p-1/t23-,25+,26-,29-/m1/s1

inchikey

  • YJQPYGGHQPGBLI-KGSXXDOSSA-M

is_conjugate_base_of

mass

  • 611.61640

monoisotopicmass

  • 611.22463

smiles

  • CO[C@@H]1[C@@H](OC(N)=O)[C@@H](O)[C@H](Oc2ccc3c([O-])c(NC(=O)c4ccc(O)c(CC=C(C)C)c4)c(=O)oc3c2C)OC1(C)C

subset

  • 3_STAR

synonym RELATED

  • novobiocin
  • novobiocin anion

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:71339

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