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CHEBI:221491 - Potashchelin B

ChEBI IDCHEBI:221491
ChEBI NamePotashchelin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC43H70N10O22
Net Charge0
Average Mass1079.081
Monoisotopic Mass1078.46661
SMILESCCCCCC/C=C\CCCC(=O)N[C@H](C(=O)N[C@H](CO)C(=O)NCC(=O)N[C@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@H]1CCCN(O)C1=O)[C@@H](C)O)[C@@H](O)C(=O)O)[C@H](O)C(=O)O
InChIInChI=1S/C43H70N10O22/c1-3-4-5-6-7-8-9-10-11-14-27(59)50-30(32(61)42(71)72)39(68)48-23(17-54)34(63)44-16-28(60)45-24(18-55)35(64)47-26(20-57)37(66)52-31(33(62)43(73)74)40(69)51-29(21(2)58)38(67)49-25(19-56)36(65)46-22-13-12-15-53(75)41(22)70/h8-9,21-26,29-33,54-58,61-62,75H,3-7,10-20H2,1-2H3,(H,44,63)(H,45,60)(H,46,65)(H,47,64)(H,48,68)(H,49,67)(H,50,59)(H,51,69)(H,52,66)(H,71,72)(H,73,74)/b9-8-/t21-,22+,23-,24-,25+,26+,29-,30+,31+,32+,33-/m1/s1
InChIKeyCPRFHUFTLRUMNV-HPBFKGMYSA-N
Species of MetaboliteComponentSourceComments
Halomonasspecies MG34 (ncbitaxon:2600296) - PubMed (32266214)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Potashchelin B (CHEBI:221491) is a polypeptide (CHEBI:15841)