CHEBI:217597 - 18-Desmethyl-vicenistatin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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 18-Desmethyl-vicenistatin
ChEBI ID CHEBI:217597
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C29H46N2O4
Net Charge 0
Average Mass 486.697
Monoisotopic Mass 486.34576
InChI InChI=1S/C29H46N2O4/c1-21-13-9-7-6-8-12-18-31-27(33)15-11-10-14-23(3)26(17-16-22(2)19-21)35-28-20-25(32)29(30-5)24(4)34-28/h7,9-11,13-16,23-26,28-30,32H,6,8,12,17-20H2,1-5H3,(H,31,33)/b9-7-,14-10-,15-11-,21-13-,22-16-/t23-,24?,25?,26-,28?,29?/m0/s1
InChIKey ITUGKYIZQDNKMM-CIEPXDEZSA-N
SMILES O=C1NCCCCC=CC=C(CC(=CC[C@@H]([C@H](C=CC=C1)C)OC2OC(C(NC)C(C2)O)C)C)C
Metabolite of Species Details
Streptomyces halstedii (NCBI:txid1944) See: PubMed
ChEBI Ontology
Outgoing 18-Desmethyl-vicenistatin (CHEBI:217597) is a aminoglycoside (CHEBI:47779)
IUPAC Name
(3Z,5Z,7S,8S,10Z,13Z,15Z)-8-[4-hydroxy-6-methyl-5-(methylamino)oxan-2-yl]oxy-7,11,13-trimethyl-1-azacycloicosa-3,5,10,13,15-pentaen-2-one
Manual Xref Database
78445288 ChemSpider
View more database links