CHEBI:68324 - bastadin 6

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name bastadin 6
ChEBI ID CHEBI:68324
Definition A macrocyclic lactam isolated from the marine sponge Ianthella and has been shown to exhibit calcium channel modulatory activity.
Stars This entity has been manually annotated by a third party.
Supplier Information ChemicalBook:CB21387988, ZINC000006090922
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Formula C34H26Br6N4O8
Net Charge 0
Average Mass 1098.01600
Monoisotopic Mass 1091.68509
InChI InChI=1S/C34H26Br6N4O8/c35-19-3-1-18-6-8-42-34(48)24(44-50)13-16-9-20(36)29(45)26(14-16)52-31-21(37)10-15(11-22(31)38)12-23(43-49)33(47)41-7-5-17-2-4-25(30(46)27(17)39)51-32(19)28(18)40/h1-4,9-11,14,45-46,49-50H,5-8,12-13H2,(H,41,47)(H,42,48)/b43-23+,44-24+
InChIKey PKTKAHOYUVDXHU-ADHDEERNSA-N
SMILES O\N=C1/Cc2cc(Br)c(Oc3cc(C\C(C(=O)NCCc4ccc(Br)c(Oc5ccc(CCNC1=O)c(Br)c5O)c4Br)=N/O)cc(Br)c3O)c(Br)c2
Metabolite of Species Details
Ianthella (NCBI:txid375145) See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
calcium channel modulator
A membrane transport modulator that is able to regulate intracellular calcium levels.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing bastadin 6 (CHEBI:68324) has role calcium channel modulator (CHEBI:38808)
bastadin 6 (CHEBI:68324) has role metabolite (CHEBI:25212)
bastadin 6 (CHEBI:68324) is a cyclic ether (CHEBI:37407)
bastadin 6 (CHEBI:68324) is a ketoxime (CHEBI:24983)
bastadin 6 (CHEBI:68324) is a lactam (CHEBI:24995)
bastadin 6 (CHEBI:68324) is a macrocycle (CHEBI:51026)
bastadin 6 (CHEBI:68324) is a organobromine compound (CHEBI:37141)
bastadin 6 (CHEBI:68324) is a polyphenol (CHEBI:26195)
IUPAC Name
(12E,25E)-4,16,21,31,36,38-hexabromo-17,32-dihydroxy-12,25-bis(hydroxyimino)-2,19-dioxa-10,27-diazapentacyclo[28.2.2.220,23.13,7.114,18]octatriaconta-1(32),3(38),4,6,14(37),15,17,20,22,30,33,35-dodecaene-11,26-dione
Synonym Source
bastadin-6 ChEBI
Registry Number Type Source
4226682 Reaxys Registry Number Reaxys
Citation Type Source
21214221 PubMed citation Europe PMC
Last Modified
22 July 2013