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CHEBI:216324 - Depsidomycin B

ChEBI IDCHEBI:216324
ChEBI NameDepsidomycin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC38H65N9O9
Net Charge0
Average Mass791.992
Monoisotopic Mass791.49052
SMILESCC[C@@H](C)[C@@H](NC=O)C(=O)N[C@H]1C(=O)N[C@H](CC(C)C)C(=O)N[C@H](C(C)C)C(=O)N2NCCC[C@H]2C(=O)N[C@H](CC(C)C)C(=O)N2NCCC[C@H]2C(=O)O[C@H]1C
InChIInChI=1S/C38H65N9O9/c1-10-23(8)30(39-19-48)34(51)45-31-24(9)56-38(55)28-14-12-16-41-47(28)36(53)26(18-21(4)5)43-33(50)27-13-11-15-40-46(27)37(54)29(22(6)7)44-32(49)25(17-20(2)3)42-35(31)52/h19-31,40-41H,10-18H2,1-9H3,(H,39,48)(H,42,52)(H,43,50)(H,44,49)(H,45,51)/t23-,24+,25-,26-,27+,28+,29-,30-,31-/m1/s1
InChIKeyQCUFYOBGGZSFHY-FBKICHDQSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (29799492)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Depsidomycin B (CHEBI:216324) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name 
(2R,3R)-2-ormamido-3-methyl-N-[(3R,6S,13R,16R,19R,20S,23S)-20-methyl-3,16-bis(2-methylpropyl)-2,5,12,15,18,22-hexaoxo-13-propan-2-yl-21-oxa-1,4,10,11,14,17,27-heptazatricyclo[21.4.0.06,11]heptacosan-19-yl]pentanamide