CHEBI:68277 - (−)-jasplakinolide Z4

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ChEBI Name (−)-jasplakinolide Z4
ChEBI ID CHEBI:68277
ChEBI ASCII Name (-)-jasplakinolide Z4
Definition A depsipeptide isolated from Jaspis splendens.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C27H39BrN4O4
Net Charge 0
Average Mass 563.52700
Monoisotopic Mass 562.21547
InChI InChI=1S/C27H39BrN4O4/c1-15(11-16(2)13-18(4)33)12-17(3)26(35)30-19(5)27(36)32(6)23(25(29)34)14-21-20-9-7-8-10-22(20)31-24(21)28/h7-11,16-19,23,31,33H,12-14H2,1-6H3,(H2,29,34)(H,30,35)/b15-11+/t16-,17-,18-,19-,23+/m0/s1
InChIKey XWCIEJNXKGXQCZ-YZTGKPPRSA-N
SMILES C[C@H](O)C[C@@H](C)\C=C(/C)C[C@H](C)C(=O)N[C@@H](C)C(=O)N(C)[C@H](Cc1c(Br)[nH]c2ccccc12)C(N)=O
Metabolite of Species Details
Jaspis sp.endens (WORMS:169842) Methanolic extract of sponge See: PubMed
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): marine metabolite
Any metabolite produced during a metabolic reaction in marine macro- and microorganisms.
animal metabolite
Any eukaryotic metabolite produced during a metabolic reaction in animals that include diverse creatures from sponges, insects to mammals.
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (−)-jasplakinolide Z4 (CHEBI:68277) has role animal metabolite (CHEBI:75767)
(−)-jasplakinolide Z4 (CHEBI:68277) has role antineoplastic agent (CHEBI:35610)
(−)-jasplakinolide Z4 (CHEBI:68277) has role marine metabolite (CHEBI:76507)
(−)-jasplakinolide Z4 (CHEBI:68277) is a depsipeptide (CHEBI:23643)
(−)-jasplakinolide Z4 (CHEBI:68277) is a indoles (CHEBI:24828)
(−)-jasplakinolide Z4 (CHEBI:68277) is a organobromine compound (CHEBI:37141)
IUPAC Name
N-[(2S,4E,6R,8S)-8-hydroxy-2,4,6-trimethylnon-4-enoyl]-L-alanyl-2-bromo-Nα-methyl-D-tryptophanamide
Registry Number Type Source
21404706 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21241058 PubMed citation Europe PMC
Last Modified
25 March 2015