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CHEBI:211370 - Rakicidin H

ChEBI IDCHEBI:211370
ChEBI NameRakicidin H
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC32H54N4O7
Net Charge0
Average Mass606.805
Monoisotopic Mass606.39925
SMILESC=C1C=CC(=O)N(C)CC(=O)N[C@@H](C(O)C(N)=O)C(=O)O[C@@H](C(C)CCCCCCCCCCCCCC)[C@H](C)C(=O)N1
InChIInChI=1S/C32H54N4O7/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-22(2)29-24(4)31(41)34-23(3)19-20-26(38)36(5)21-25(37)35-27(32(42)43-29)28(39)30(33)40/h19-20,22,24,27-29,39H,3,6-18,21H2,1-2,4-5H3,(H2,33,40)(H,34,41)(H,35,37)/t22?,24-,27-,28?,29-/m0/s1
InChIKeyPBEXJPQHKMRLOS-MIZKJSANSA-N
Species of MetaboliteComponentSourceComments
Micromonospora (ncbitaxon:1873) - DOI (10.1016/j.tet.2018.06.039)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Rakicidin H (CHEBI:211370) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name 
2-[(3S,14S,15S)-15-hexadecan-2-yl-7,14-dimethyl-11-methylidene-2,5,8,13-tetraoxo-1-oxa-4,7,12-triazacyclopentadec-9-en-3-yl]-2-hydroxyacetamide