CHEBI:66110 - jaspamide G

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ChEBI Name jaspamide G
ChEBI ID CHEBI:66110
Definition A cyclodepsipeptide isolated from Jaspis splendens. A derivative of jaspamide, it exhibits anti-tumour activity.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C36H43BrN4O7
Net Charge 0
Average Mass 723.65300
Monoisotopic Mass 722.23151
InChI InChI=1S/C36H43BrN4O7/c1-20-14-22(3)48-32(44)18-30(25-10-12-26(43)13-11-25)40-35(46)31(17-28-27-8-6-7-9-29(27)39-33(28)37)41(5)36(47)23(4)38-34(45)21(2)16-24(15-20)19-42/h6-13,15,19-23,30-31,39,43H,14,16-18H2,1-5H3,(H,38,45)(H,40,46)/b24-15+/t20-,21+,22+,23+,30-,31-/m1/s1
InChIKey SBOUVKPLPSBCNP-LYDSZSQBSA-N
SMILES C[C@H]1C[C@@H](C)\C=C(/C[C@H](C)C(=O)N[C@@H](C)C(=O)N(C)[C@H](Cc2c(Br)[nH]c3ccccc23)C(=O)N[C@H](CC(=O)O1)c1ccc(O)cc1)C=O
Metabolite of Species Details
Jaspis sp.endens (WORMS:169842) See: DOI
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): animal metabolite
Any eukaryotic metabolite produced during a metabolic reaction in animals that include diverse creatures from sponges, insects to mammals.
marine metabolite
Any metabolite produced during a metabolic reaction in marine macro- and microorganisms.
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing jaspamide G (CHEBI:66110) has role animal metabolite (CHEBI:75767)
jaspamide G (CHEBI:66110) has role antineoplastic agent (CHEBI:35610)
jaspamide G (CHEBI:66110) has role marine metabolite (CHEBI:76507)
jaspamide G (CHEBI:66110) is a aldehyde (CHEBI:17478)
jaspamide G (CHEBI:66110) is a cyclodepsipeptide (CHEBI:35213)
jaspamide G (CHEBI:66110) is a macrocycle (CHEBI:51026)
jaspamide G (CHEBI:66110) is a organobromine compound (CHEBI:37141)
IUPAC Name
(4R,7R,10S,13S,15E,17R,19S)-7-[(2-bromo-1H-indol-3-yl)methyl]-4-(4-hydroxyphenyl)-8,10,13,17,19-pentamethyl-2,6,9,12-tetraoxo-1-oxa-5,8,11-triazacyclononadec-15-ene-15-carbaldehyde
Manual Xref Database
23076431 ChemSpider
View more database links
Registry Number Type Source
11016308 Reaxys Registry Number Reaxys
Last Modified
13 April 2015
General Comment
2013-03-06 Tetrahedron (2007),63, 5212 - 5219.