CHEBI:204124 - Guineamide D

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Guineamide D
ChEBI ID CHEBI:204124
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C36H56N4O9
Net Charge 0
Average Mass 688.863
Monoisotopic Mass 688.40473
InChI InChI=1S/C36H56N4O9/c1-12-13-26-23(8)35(45)48-31(22(6)7)34(44)40(10)29(20(2)3)36(46)49-30(21(4)5)33(43)39(9)27(32(42)37-19-28(41)38-26)18-24-14-16-25(47-11)17-15-24/h14-17,20-23,26-27,29-31H,12-13,18-19H2,1-11H3,(H,37,42)(H,38,41)/t23?,26?,27-,29+,30+,31+/m1/s1
InChIKey UFZHQKNOTHZBQG-WRCAOINYSA-N
SMILES O=C1O[C@H](C(=O)N([C@@H](C(=O)NCC(=O)NC(C(C(O[C@H](C(N([C@H]1C(C)C)C)=O)C(C)C)=O)C)CCC)CC2=CC=C(OC)C=C2)C)C(C)C
Metabolite of Species Details
Lyngbya majuscula (NCBI:txid158786) See: PubMed
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Guineamide D (CHEBI:204124) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name
(2S,5S,8S,11R)-11-[(4-methoxyphenyl)methyl]-4,10,18-trimethyl-2,5,8-tri(propan-2-yl)-17-propyl-1,7-dioxa-4,10,13,16-tetrazacyclononadecane-3,6,9,12,15,19-hexone
Manual Xref Database
10140868 ChemSpider
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