CHEBI:192688 - lyngbyatoxin B

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 lyngbyatoxin B
ChEBI ID CHEBI:192688
Stars This entity has been manually annotated by a third party.
Submitter Anne Morgat
Supplier Information
Download Molfile XML SDF
Formula C27H39N3O3
Net Charge 0
Average Mass 453.627
Monoisotopic Mass 453.29914
InChI InChI=1S/C27H39N3O3/c1-8-27(6,12-11-22(32)16(2)3)20-9-10-21-23-18(14-28-24(20)23)13-19(15-31)29-26(33)25(17(4)5)30(21)7/h8-10,14,17,19,22,25,28,31-32H,1-2,11-13,15H2,3-7H3,(H,29,33)/t19-,22?,25-,27-/m0/s1
InChIKey RLQWNZUFDRUTMZ-LERHOHMLSA-N
SMILES C=1(C=2NC=C3C[C@@H](CO)NC([C@H](C(C)C)N(C)C(C32)=CC1)=O)[C@](CCC(C(C)=C)O)(C=C)C
ChEBI Ontology
Outgoing lyngbyatoxin B (CHEBI:192688) has functional parent lyngbyatoxin A (CHEBI:192687)
lyngbyatoxin B (CHEBI:192688) is a indoles (CHEBI:24828)
Synonym Source
lyngbyatoxin B UniProt
Manual Xref Database
CPD-18331 MetaCyc accession
View more database links
Citation Waiting for Citations Type Source
15366877 PubMed citation SUBMITTER