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CHEBI:80109 - Cephabacin F3

ChEBI IDCHEBI:80109
ChEBI NameCephabacin F3
Stars
DownloadsMolfile
FormulaC32H51N11O13S
Net Charge0
Average Mass829.891
Monoisotopic Mass829.33885
SMILESC[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)[C@H](O)CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@](NC=O)(NC(=O)CCC[C@@H](N)C(=O)O)[C@H]2SC1
InChIInChI=1S/C32H51N11O13S/c1-14(33)24(48)39-15(2)25(49)40-16(3)26(50)41-19(7-5-9-37-31(35)36)20(45)10-22(47)56-11-17-12-57-30-32(38-13-44,29(55)43(30)23(17)28(53)54)42-21(46)8-4-6-18(34)27(51)52/h13-16,18-20,30,45H,4-12,33-34H2,1-3H3,(H,38,44)(H,39,48)(H,40,49)(H,41,50)(H,42,46)(H,51,52)(H,53,54)(H4,35,36,37)/t14-,15-,16-,18+,19-,20+,30+,32+/m0/s1
InChIKeyBGRDGTOTEZBYJX-LNMVFDGZSA-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)
Cephabacin F3 (CHEBI:80109) is a peptide (CHEBI:16670)
Synonym  Source
CephabacinKEGG COMPOUND
Manual XrefsDatabases
C15824KEGG COMPOUND