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CHEBI:199565 - Georgamide

ChEBI IDCHEBI:199565
ChEBI NameGeorgamide
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SubmitterMetaboLights
DownloadsMolfile
FormulaC46H69N5O10
Net Charge0
Average Mass852.083
Monoisotopic Mass851.50444
SMILESC#CCCCC1OC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)N(C)C(=O)[C@H]([C@H](C)CC)OC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H]([C@@H](C)O)NC(=O)C1(C)C
InChIInChI=1S/C46H69N5O10/c1-13-15-17-24-34-46(9,10)45(59)48-36(30(8)52)41(55)49(11)33(26-31-21-18-16-19-22-31)40(54)51-25-20-23-32(51)43(57)61-38(29(7)14-2)42(56)50(12)37(28(5)6)39(53)47-35(27(3)4)44(58)60-34/h1,16,18-19,21-22,27-30,32-38,52H,14-15,17,20,23-26H2,2-12H3,(H,47,53)(H,48,59)/t29-,30-,32+,33+,34?,35+,36+,37+,38+/m1/s1
InChIKeyPQGOCRXEFILOCI-GHHDHJOVSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Georgamide (CHEBI:199565) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name 
(3S,6S,13S,16S,19S,22S)-3-benzyl-19-[(2R)-butan-2-yl]-6-[(1R)-1-hydroxyethyl]-4,9,9,17-tetramethyl-10-pent-4-ynyl-13,16-di(propan-2-yl)-11,20-dioxa-1,4,7,14,17-pentazabicyclo[20.3.0]pentacosane-2,5,8,12,15,18,21-heptone
Manual XrefsDatabases
8852368ChemSpider