bastadin 6 (CHEBI:68324)

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CHEBI:68324 - bastadin 6

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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

Download	Molfile XML SDF

Formula

C34H26Br6N4O8

Net Charge

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[28.2.2.2^20,23.1^3,7.1^14,18]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

CHEBI:68324 - bastadin 6

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