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Concept information

Preferred term

frankobactin b2  

Type

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

Broader concept

charge

  • 0

formula

  • C33H49N9O12

inchi

  • InChI=1S/C33H49N9O12/c1-19-27(40-26(45)16-35-28(46)23-17-53-31(39-23)20-8-3-4-12-25(20)44)32(49)41(2)24(11-6-14-36-51)30(48)37-21(9-5-13-34)29(47)38-22(33(50)54-19)10-7-15-42(52)18-43/h3-4,8,12,18-19,21-24,27,36,44,51-52H,5-7,9-11,13-17,34H2,1-2H3,(H,35,46)(H,37,48)(H,38,47)(H,40,45)/t19-,21+,22+,23+,24+,27-/m1/s1

inchikey

  • PUSWLFCHWVKWQE-OUBBJWQNSA-N

mass

  • 763.806

monoisotopicmass

  • 763.35007

smiles

  • O=C1O[C@@H]([C@@H](NC(=O)CNC(=O)[C@H]2N=C(C3=C(O)C=CC=C3)OC2)C(=O)N([C@@H](CCCNO)C(N[C@H](C(N[C@H]1CCCN(O)C=O)=O)CCCN)=O)C)C

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:221209

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