CHEBI:87400 - UK 65662

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ChEBI Name UK 65662
ChEBI ID CHEBI:87400
Definition A cyclodepsipeptide antibiotic that is isolated from Streptomyces sp. SNA15896 and also exhibits antitumour activity.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Gemma Holliday
Supplier Information
Download Molfile XML SDF
Formula C55H66N10O14S2
Net Charge 0
Average Mass 1155.30100
Monoisotopic Mass 1154.42014
InChI InChI=1S/C55H66N10O14S2/c1-26(2)81-51-42-50(75)65(10)55(22-28(55)4)53(77)79-24-35(60-45(70)40-38(66)19-31-15-11-13-17-33(31)58-40)43(68)56-29(5)47(72)62(7)37(25-80-51)49(74)64(9)54(21-27(54)3)52(76)78-23-36(44(69)57-30(6)48(73)63(42)8)61-46(71)41-39(67)20-32-16-12-14-18-34(32)59-41/h11-20,26-30,35-37,42,51,66-67H,21-25H2,1-10H3,(H,56,68)(H,57,69)(H,60,70)(H,61,71)/t27-,28-,29-,30-,35+,36+,37-,42+,51-,54-,55-/m0/s1
InChIKey HDMUZLQWDPUHND-PGKBBLNOSA-N
SMILES CC(C)S[C@@H]1SC[C@@H]2N(C)C(=O)[C@H](C)NC(=O)[C@@H](COC(=O)[C@@]3(C[C@@H]3C)N(C)C(=O)[C@H]1N(C)C(=O)[C@H](C)NC(=O)[C@@H](COC(=O)[C@@]1(C[C@@H]1C)N(C)C2=O)NC(=O)c1nc2ccccc2cc1O)NC(=O)c1nc2ccccc2cc1O
Metabolite of Species Details
Streptomyces sp. SNA15896 (NCBI:txid497689) of strain SNA15896 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): bacterial metabolite
Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
(via peptide antibiotic )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing UK 65662 (CHEBI:87400) has role bacterial metabolite (CHEBI:76969)
UK 65662 (CHEBI:87400) is a cyclodepsipeptide (CHEBI:35213)
UK 65662 (CHEBI:87400) is a dithioacetal (CHEBI:59794)
UK 65662 (CHEBI:87400) is a heterodetic cyclic peptide (CHEBI:24533)
UK 65662 (CHEBI:87400) is a hydroxyquinoline (CHEBI:38774)
UK 65662 (CHEBI:87400) is a peptide antibiotic (CHEBI:25903)
IUPAC Name
N,N'-{(1S,1'R,2S,2''S,8'R,11'S,14'R,17'S,21'R,24'S,27'S)-2,2'',3',11',13',16',24',26'-octamethyl-2',5',9',12',15',18',22',25'-octaoxo-27'-[(propan-2-yl)sulfanyl]-6',19'-dioxa-28'-thia-3',10',13',16',23',26'-hexaazadispiro[cyclopropane-1,4'-bicyclo[12.12.3]nonacosane-17',1''-cyclopropane]-8',21'-diyl}bis(3-hydroxyquinoline-2-carboxamide)
Synonyms Sources
SW-163F ChEBI
UK 66,652 ChemIDplus
UK-65662 ChemIDplus
Registry Numbers Types Sources
11250491 Reaxys Registry Number Reaxys
120832-02-2 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
18071270 PubMed citation Europe PMC
19514719 PubMed citation SUBMITTER
2925512 PubMed citation Europe PMC
Last Modified
21 August 2015