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ONTOLOGY REPORT - ANNOTATIONS


Term:symphytine
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Accession:CHEBI:9375 term browser browse the term
Definition:A but-2-enoate ester obtained by formal condensation of the carboxy group of (2E)-2-methylbut-2-enoic acid with the 1-hydroxy group of (1R,7aR)-7-({[(2S,3S)-2,3-dihydroxy-2-isopropylbutanoyl]oxy}methyl)-2,3,5,7a-tetrahydro-1H-pyrrolizin-1-ol.
Synonyms:exact_synonym: (1R,7aR)-7-({[(2S,3S)-2,3-dihydroxy-2-isopropylbutanoyl]oxy}methyl)-2,3,5,7a-tetrahydro-1H-pyrrolizin-1-yl (2E)-2-methylbut-2-enoate
 related_synonym: 7-Tiglyl-9-(-)-viridiflorylretronecine;   7-Tiglylretronecine viridiflorate;   Formula=C20H31NO6;   InChI=1S/C20H31NO6/c1-6-13(4)18(23)27-16-8-10-21-9-7-15(17(16)21)11-26-19(24)20(25,12(2)3)14(5)22/h6-7,12,14,16-17,22,25H,8-11H2,1-5H3/b13-6+/t14-,16+,17+,20-/m0/s1;   InChIKey=MVWPTZQHBOWRTF-SMLWLWDZSA-N;   SMILES=[H][C@@]12[C@@H](CCN1CC=C2COC(=O)[C@](O)(C(C)C)[C@H](C)O)OC(=O)C(\\C)=C\\C
 xref: AGR:IND90038070;   CAS:22571-95-5;   KEGG:C10409;   KNApSAcK:C00002123;   PMID:11430014;   PMID:15482618;   PMID:17401847;   PMID:287835;   PMID:6579012;   PMID:7128756;   Reaxys:1554309


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Term Annotations click to browse term
  CHEBI ontology 19770
    chemical entity 19769
      atom 19768
        nonmetal atom 19642
          nitrogen atom 18437
            nitrogen molecular entity 18437
              organonitrogen compound 18232
                organonitrogen heterocyclic compound 17207
                  pyrrolizines 183
                    symphytine 0
                      symphytine oxide 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19770
    subatomic particle 19768
      composite particle 19768
        hadron 19768
          baryon 19768
            nucleon 19768
              atomic nucleus 19768
                atom 19768
                  main group element atom 19655
                    p-block element atom 19655
                      carbon group element atom 19548
                        carbon atom 19537
                          organic molecular entity 19537
                            organic group 18451
                              organic divalent group 18445
                                organodiyl group 18445
                                  carbonyl group 18346
                                    carbonyl compound 18346
                                      carboxylic acid 18019
                                        monocarboxylic acid 17277
                                          fatty acid 15815
                                            unsaturated fatty acid 904
                                              monounsaturated fatty acid 404
                                                butenoic acid 19
                                                  2-butenoic acid 19
                                                    but-2-enoate ester 0
                                                      symphytine 0
                                                        symphytine oxide 0
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RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.