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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.

Term:Microviridin M
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Accession:CHEBI:221991 term browser browse the term
Synonyms:exact_synonym: (2S)-2-[[(1S,4S,10S,13S,19S,22S,25S,29R,30S,33S,44S)-30-[[(2S)-2-amino-3-methylbutanoyl]amino]-4-[(4-hydroxyphenyl)methyl]-22-(1H-indol-3-ylmethyl)-29-methyl-33-(2-methylpropyl)-2,5,11,16,21,24,27,31,34,41,46,48-dodecaoxo-15,28-dioxa-3,6,12,20,23,32,35,40,45,47-decazatetracyclo[17.16.11.213,25.06,10]octatetracontane-44-carbonyl]amino]-3-phenylpropanoic acid
 related_synonym: Formula=C72H94N14O19;   InChI=1S/C72H94N14O19/c1-37(2)30-49-64(94)76-46-18-11-12-28-74-56(88)26-24-47(63(93)83-53(72(102)103)32-40-14-7-6-8-15-40)77-62(92)48-25-27-57(89)104-36-54(84-68(98)55-19-13-29-86(55)71(101)52(82-61(46)91)31-41-20-22-43(87)23-21-41)67(97)80-51(34-58(90)105-39(5)60(70(100)81-49)85-69(99)59(73)38(3)4)66(96)79-50(65(95)78-48)33-42-35-75-45-17-10-9-16-44(42)45/h6-10,14-17,20-23,35,37-39,46-55,59-60,75,87H,11-13,18-19,24-34,36,73H2,1-5H3,(H,74,88)(H,76,94)(H,77,92)(H,78,95)(H,79,96)(H,80,97)(H,81,100)(H,82,91)(H,83,93)(H,84,98)(H,85,99)(H,102,103)/t39-,46+,47+,48+,49+,50+,51+,52+,53+,54+,55+,59+,60+/m1/s1;   InChIKey=VORFWDWWIMRFMG-YIXBORKCSA-N;   SMILES=O=C1N[C@H](C(=O)N[C@H](C(=O)O)CC2=CC=CC=C2)CCC(=O)NCCCC[C@@H]3NC(=O)[C@H](CC(C)C)NC([C@H]([C@H](OC(C[C@H]4C(N[C@H](C(N[C@H]1CCC(=O)OC[C@H](NC(=O)[C@H]5N(C(=O)[C@H](CC6=CC=C(O)C=C6)NC3=O)CCC5)C(=O)N4)=O)CC=7C8=C(C=CC=C8)NC7)=O)=O)C)NC(=O)[C@@H](N)C(C)C)=O


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  CHEBI ontology 0
    chemical entity 0
      group 0
        organic group 0
          amino-acid residue 0
            peptide 0
              Microviridin M 0
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  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            heteroorganic entity 0
                              organochalcogen compound 0
                                organooxygen compound 0
                                  carbon oxoacid 0
                                    carboxylic acid 0
                                      carboacyl group 0
                                        univalent carboacyl group 0
                                          carbamoyl group 0
                                            carboxamide 0
                                              peptide 0
                                                Microviridin M 0
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