CHEBI:222521 - Tasikamide B

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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 Tasikamide B
ChEBI ID CHEBI:222521
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C62H80N8O12
Net Charge 0
Average Mass 1129.366
Monoisotopic Mass 1128.58957
InChI InChI=1S/C62H80N8O12/c1-9-38(4)51-61(78)70(7)54(55(73)41-24-17-14-18-25-41)60(77)65-48(34-43-36-63-52-45(43)28-22-29-49(52)80-8)58(75)64-39(5)33-50(72)82-56(42-26-19-15-20-27-42)53(59(76)66-51)67-57(74)40(6)68-69-47-31-30-44(71)35-46(47)62(79)81-32-21-13-11-10-12-16-23-37(2)3/h14-15,17-20,22,24-31,35-39,48,51,53-56,63,69,71,73H,9-13,16,21,23,32-34H2,1-8H3,(H,64,75)(H,65,77)(H,66,76)(H,67,74)/t38-,39-,48+,51-,53-,54-,55-,56+/m0/s1
InChIKey DVJJWNNETKNIPP-MQCGSOSJSA-N
SMILES O=C1N([C@H](C(=O)N[C@@H](C(=O)N[C@@H](C)CC(O[C@@H]([C@@H](C(N[C@H]1[C@H](CC)C)=O)NC(=O)C(=NNC2=C(C(=O)OCCCCCCCCC(C)C)C=C(O)C=C2)C)C3=CC=CC=C3)=O)CC=4C5=C(C(OC)=CC=C5)NC4)[C@@H](O)C6=CC=CC=C6)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 Tasikamide B (CHEBI:222521) is a oligopeptide (CHEBI:25676)