Cyanopeptolin S (BioCAD00000009071)
Metabolite Card
Chinese Name:
Formula: C40H63N9O14S (925.4215)
SMILES:
CCC(C)C1NC(=O)C(Cc2ccccc2)N(C)C(=O)C(C(C)CC)N2C(O)CCC(NC(=O)C(CCCNC(N)=N)NC(=O)C(NC(=O)C(O)COS(O)(=O)=O)C(C)OC1=O)C2=O
Synonyms [en]
Cyanopeptolin S; [(2~{R})-3-[[(2~{S},5~{S},8~{S},11~{R},12~{S},15~{S},18~{S},21~{R})-5-benzyl-15-(3-guanidinopropyl)-21-hydroxy-4,11-dimethyl-2,8-bis[(1~{S})-1-methylpropyl]-3,6,9,13,16,22-hexaoxo-10-oxa-1,4,7,14,17-pentazabicyclo[16.3.1]docosan-12-yl]amino]-2-hydroxy-3-oxo-propyl] hydrogen sulfate; [3-[[(2~{R},5~{R},8~{R},11~{S},12~{S},15~{R},18~{R},21~{R})-5-benzyl-15-(3-guanidinopropyl)-21-hydroxy-4,11-dimethyl-2,8-bis[(1~{R})-1-methylpropyl]-3,6,9,13,16,22-hexaoxo-10-oxa-1,4,7,14,17-pentazabicyclo[16.3.1]docosan-12-yl]amino]-2-hydroxy-3-oxo-propyl] hydrogen sulfate; [(2R)-3-[[(2S,5S,8S,11R,12S,15S,18S,21R)-5-benzyl-2,8-bis[(2S)-butan-2-yl]-15-(3-carbamimidamidopropyl)-21-hydroxy-4,11-dimethyl-3,6,9,13,16,22-hexaoxo-10-oxa-1,4,7,14,17-pentazabicyclo[16.3.1]docosan-12-yl]amino]-2-hydroxy-3-oxopropyl] hydrogen sulfate; CHEMBL1076838
Note
DBLinks
- CAS Registry Number:
- PubChem CID: 23724558
- ChEBI: 80071
- HMDB:
- LipidMaps:
- KEGG: C15743
- BioCyc:
- NCBI MeSH:
- Wikipedia:
Other DBLinks
- PubChem: 23724558
- ChEBI: ChEBI:80071
- KEGG: C15743
- Metlin: METLIN_71074
- Coconut NaturalProduct: CNP0278679.2
- Coconut NaturalProduct: CNP0491870.1
- Coconut NaturalProduct: CNP0491870.2
- PMHub: MS000024782
Class / Ontology
- ChEBI: [CHEBI:80071] Cyanopeptolin S
- Coconut NaturalProduct: [Ahp-containing cyclodepsipeptides] Ahp-containing cyclodepsipeptides