EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:223034 - Scytocyclamide B

ChEBI IDCHEBI:223034
ChEBI NameScytocyclamide B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC63H110N14O19
Net Charge0
Average Mass1367.652
Monoisotopic Mass1366.80717
SMILESCCCCCC1CC(=O)N[C@@H](C(C)C)C(=O)N[C@H](C(O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(O)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N(C)[C@@H]([C@@H](C)CC)C(=O)N[C@H](C(O)C(N)=O)C(=O)N[C@H]([C@H](C)O)C(=O)N2CCC[C@H]2C(=O)N[C@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N1
InChIInChI=1S/C63H110N14O19/c1-16-18-19-21-36-27-41(81)70-42(29(5)6)56(89)74-45(49(82)30(7)8)58(91)66-33(12)53(86)73-46(50(83)31(9)10)59(92)68-37(23-24-40(64)80)62(95)76(15)48(32(11)17-2)61(94)75-47(51(84)52(65)85)60(93)72-44(35(14)79)63(96)77-25-20-22-39(77)55(88)69-38(26-28(3)4)54(87)71-43(34(13)78)57(90)67-36/h28-39,42-51,78-79,82-84H,16-27H2,1-15H3,(H2,64,80)(H2,65,85)(H,66,91)(H,67,90)(H,68,92)(H,69,88)(H,70,81)(H,71,87)(H,72,93)(H,73,86)(H,74,89)(H,75,94)/t32-,33-,34+,35-,36?,37-,38+,39-,42-,43-,44+,45+,46+,47+,48-,49?,50?,51?/m0/s1
InChIKeyOIXICRGCRLGQCN-KLFTUGTHSA-N
Species of MetaboliteComponentSourceComments
Scytonema hofmannii PCC 7110 (ncbitaxon:128403) - PubMed (33042096)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Scytocyclamide B (CHEBI:223034) is a polypeptide (CHEBI:15841)