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CHEBI:199348 - Guineamide B

ChEBI IDCHEBI:199348
ChEBI NameGuineamide B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC32H45N5O6S
Net Charge0
Average Mass627.808
Monoisotopic Mass627.30906
SMILESCC1NC(=O)c2csc(n2)[C@H](C)NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](C(C)C)OC(=O)C1C
InChIInChI=1S/C32H45N5O6S/c1-17(2)25-30(40)36(8)24(15-22-13-11-10-12-14-22)28(39)34-21(7)29-35-23(16-44-29)27(38)33-20(6)19(5)32(42)43-26(18(3)4)31(41)37(25)9/h10-14,16-21,24-26H,15H2,1-9H3,(H,33,38)(H,34,39)/t19?,20?,21-,24-,25-,26-/m0/s1
InChIKeyHCDWKPJRUMSHJR-LYUNOVLRSA-N
Species of MetaboliteComponentSourceComments
Lyngbya majuscula (ncbitaxon:158786) - PubMed (12828459)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Guineamide B (CHEBI:199348) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name 
(2S,5S,8S,11S)-5-benzyl-2,6,9,14,15-pentamethyl-8,11-di(propan-2-yl)-12-oxa-20-thia-3,6,9,16,21-pentazabicyclo[16.2.1]henicosa-1(21),18-diene-4,7,10,13,17-pentone
Manual XrefsDatabases
8637051ChemSpider