CHEBI:198921 - RK-1355B

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name RK-1355B
ChEBI ID CHEBI:198921
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C54H64N10O15S2
Net Charge 0
Average Mass 1157.280
Monoisotopic Mass 1156.39940
InChI InChI=1S/C54H64N10O15S2/c1-10-80-50-41-49(74)64(9)54(22-27(54)3)52(76)79-24-34(59-44(69)39-37(65)19-30-15-11-13-17-32(30)57-39)42(67)55-28(4)46(71)61(6)36(25-81(50)77)48(73)63(8)53(21-26(53)2)51(75)78-23-35(43(68)56-29(5)47(72)62(41)7)60-45(70)40-38(66)20-31-16-12-14-18-33(31)58-40/h11-20,26-29,34-36,41,50,65-66H,10,21-25H2,1-9H3,(H,55,67)(H,56,68)(H,59,69)(H,60,70)
InChIKey UEKGGILKONDTLM-UHFFFAOYSA-N
SMILES S1(=O)C(SCC)C2N(C(=O)C(NC(=O)C(NC(=O)C3=NC=4C(=CC=CC4)C=C3O)COC(C5(N(C(C(C1)N(C(=O)C(NC(=O)C(NC(=O)C6=NC=7C(=CC=CC7)C=C6O)COC(C8(N(C2=O)C)C(C)C8)=O)C)C)=O)C)C(C)C5)=O)C)C
Metabolite of Species Details
Streptomyces (NCBI:txid1883) 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 )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing RK-1355B (CHEBI:198921) is a cyclodepsipeptide (CHEBI:35213)
Manual Xref Database
78443895 ChemSpider
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