CHEBI:218719 - Verucopeptin

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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 Verucopeptin
ChEBI ID CHEBI:218719
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C43H73N7O13
Net Charge 0
Average Mass 896.093
Monoisotopic Mass 895.52664
InChI InChI=1S/C43H73N7O13/c1-12-26(4)18-27(5)19-28(6)20-29(7)38-31(61-11)15-16-43(59,63-38)42(8,58)41(57)46-36-37(25(2)3)62-35(54)24-48(10)33(52)21-44-32(51)22-47(9)34(53)23-49(60)39(55)30-14-13-17-45-50(30)40(36)56/h20,25-28,30-31,36-38,45,58-60H,12-19,21-24H2,1-11H3,(H,44,51)(H,46,57)/b29-20+
InChIKey IKTLLLGZSOKVRF-ZTKZIYFRSA-N
SMILES O=C1N2NCCCC2C(=O)N(O)CC(=O)N(CC(=O)NCC(N(CC(OC(C1NC(=O)C(O)(C3(OC(/C(=C/C(CC(CC(CC)C)C)C)/C)C(OC)CC3)O)C)C(C)C)=O)C)=O)C
Metabolite of Species Details
Actinomadura (NCBI:txid1988) 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 Verucopeptin (CHEBI:218719) is a cyclodepsipeptide (CHEBI:35213)
Verucopeptin (CHEBI:218719) is a glycoside (CHEBI:24400)
IUPAC Name
2-hydroxy-N-(17-hydroxy-8,14-dimethyl-2,6,9,12,15,18-hexaoxo-4-propan-2-yl-5-oxa-1,8,11,14,17,23-hexazabicyclo[17.4.0]tricosan-3-yl)-2-[2-hydroxy-5-methoxy-6-[(E)-4,6,8-trimethyldec-2-en-2-yl]oxan-2-yl]propanamide
Manual Xref Database
4948166 ChemSpider
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