CHEBI:222118 - Auyuittuqamide 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 Auyuittuqamide B
ChEBI ID CHEBI:222118
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C49H80N10O12
Net Charge 0
Average Mass 1001.237
Monoisotopic Mass 1000.59572
InChI InChI=1S/C49H80N10O12/c1-25(2)20-32-47(69)59(14)41(30(11)61)46(68)56-38(27(5)6)48(70)57(12)34(21-31-18-16-15-17-19-31)43(65)50-23-36(63)54-37(26(3)4)44(66)53-33(24-60)42(64)55-39(28(7)8)49(71)58(13)40(29(9)10)45(67)51-22-35(62)52-32/h15-19,25-30,32-34,37-41,60-61H,20-24H2,1-14H3,(H,50,65)(H,51,67)(H,52,62)(H,53,66)(H,54,63)(H,55,64)(H,56,68)/t30?,32-,33-,34-,37-,38-,39-,40-,41-/m0/s1
InChIKey XDKZAPYHHPZYCN-MLYXPBMMSA-N
SMILES O=C1N([C@H](C(=O)NCC(=O)N[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)N([C@H](C(NCC(N[C@H](C(N[C@H](C(N[C@H]1C(C)C)=O)CO)=O)C(C)C)=O)=O)CC2=CC=CC=C2)C)C(C)C)C(O)C)C)CC(C)C)C(C)C)C
Metabolite of Species Details
Sesquicillium (NCBI:txid122396) 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 Auyuittuqamide B (CHEBI:222118) is a oligopeptide (CHEBI:25676)