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CHEBI:80046 - Myxochromide S3

ChEBI IDCHEBI:80046
ChEBI NameMyxochromide S3
Stars
DownloadsMolfile
FormulaC40H56N6O8
Net Charge0
Average Mass748.922
Monoisotopic Mass748.41596
SMILESC/C=C/C=C/C=C/C=C/C=C/C=C/C=C/C=C/C(=O)N(C)[C@@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)O[C@@H]1C
InChIInChI=1S/C40H56N6O8/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-34(48)46(7)35-30(6)54-40(53)31(24-25-33(41)47)44-37(50)29(5)42-36(49)28(4)43-38(51)32(26-27(2)3)45-39(35)52/h8-23,27-32,35H,24-26H2,1-7H3,(H2,41,47)(H,42,49)(H,43,51)(H,44,50)(H,45,52)/b9-8+,11-10+,13-12+,15-14+,17-16+,19-18+,21-20+,23-22+/t28-,29-,30+,31-,32-,35-/m0/s1
InChIKeyOPTHDMYHZAOJMC-GHQGPCFMSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Myxochromide S3 (CHEBI:80046) is a cyclodepsipeptide (CHEBI:35213)
Manual XrefsDatabases
C15716KEGG COMPOUND