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CHEBI:220844 - Streptosactin

ChEBI IDCHEBI:220844
ChEBI NameStreptosactin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC47H72N20O19S2
Net Charge0
Average Mass1285.348
Monoisotopic Mass1284.47240
SMILESC[C@H](NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H]1CSC(CO)(C(=O)N[C@@H](Cc2cncn2)C(=O)N[C@@H](CO)C(=O)NC2CSC(C(=O)N[C@@H](CCCN=C(N)N)C(=O)O)NC(=O)CNC(=O)CNC2=O)NC(=O)[C@@H]2CCCN2C(=O)CNC1=O
InChIInChI=1S/C47H72N20O19S2/c1-20(58-35(76)22(48)9-30(49)71)34(75)60-25(14-68)39(80)63-28-17-88-47(18-70,66-41(82)29-5-3-7-67(29)33(74)13-56-37(28)78)45(86)64-24(8-21-10-52-19-57-21)38(79)61-26(15-69)40(81)62-27-16-87-43(65-32(73)12-54-31(72)11-55-36(27)77)42(83)59-23(44(84)85)4-2-6-53-46(50)51/h10,19-20,22-29,43,68-70H,2-9,11-18,48H2,1H3,(H2,49,71)(H,52,57)(H,54,72)(H,55,77)(H,56,78)(H,58,76)(H,59,83)(H,60,75)(H,61,79)(H,62,81)(H,63,80)(H,64,86)(H,65,73)(H,66,82)(H,84,85)(H4,50,51,53)/t20-,22-,23-,24-,25-,26-,27?,28-,29-,43?,47?/m0/s1
InChIKeyXCCBWDZIVGIZHM-MLJYCRHWSA-N
Species of MetaboliteComponentSourceComments
Streptococcus thermophilus (ncbitaxon:1308) - PubMed (32845143)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Streptosactin (CHEBI:220844) is a polypeptide (CHEBI:15841)