CHEBI:227411 - SW-163A

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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 SW-163A
ChEBI ID CHEBI:227411
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C34H42N2O12
Net Charge 0
Average Mass 670.712
Monoisotopic Mass 670.27377
InChI InChI=1S/C34H42N2O12/c1-7-18(2)27-32(43)45-19(3)25(36-29(40)22-14-11-15-23(26(22)38)35-17-37)31(42)46-20(4)30(41)47-24(16-21-12-9-8-10-13-21)28(39)34(5,6)33(44)48-27/h8-15,17-20,24-25,27-28,38-39H,7,16H2,1-6H3,(H,35,37)(H,36,40)
InChIKey AOOVQQYJUKCBCN-UHFFFAOYSA-N
SMILES O=C1OC(C(=O)OC(C(NC(=O)C2=C(O)C(NC=O)=CC=C2)C(=O)OC(C(OC(C(C1(C)C)O)CC3=CC=CC=C3)=O)C)C)C(CC)C
Metabolite of Species Details
Streptomyces (NCBI:txid1883) 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 SW-163A (CHEBI:227411) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name
N-(15-benzyl-10-butan-2-yl-14-hydroxy-3,7,13,13-tetramethyl-2,5,9,12-tetraoxo-1,4,8,11-tetraoxacyclopentadec-6-yl)-3-ormamido-2-hydroxybenzamide
Manual Xref Database
8071763 ChemSpider
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