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CHEBI:203635 - SCH 42282

ChEBI IDCHEBI:203635
ChEBI NameSCH 42282
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SubmitterMetaboLights
DownloadsMolfile
FormulaC37H68N2O15
Net Charge0
Average Mass780.950
Monoisotopic Mass780.46197
SMILESCCC1CCCC(CC)C(=O)NCCCC(CC)C(O[C@H]2O[C@H](C)[C@@H](O)[C@H](N)[C@@H]2O[C@@H]2O[C@@H](CO)[C@H](O[C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)[C@@H](O)[C@@H]2O)CC1
WURCSWURCS=2.0/3,3,2/[a1122m-1a_1-5_1*OC^XC^XCCCNCC^XCCCC^XCC$3/14CC/10CC/9=O/4CC_3*N][a1211h-1a_1-5][a1211h-1b_1-5]/1-2-3/a2-b1_b4-c1
InChIInChI=1S/C37H68N2O15/c1-5-19-10-8-11-21(7-3)34(48)39-15-9-12-20(6-2)22(14-13-19)50-37-33(25(38)26(42)18(4)49-37)54-36-31(47)29(45)32(24(17-41)52-36)53-35-30(46)28(44)27(43)23(16-40)51-35/h18-33,35-37,40-47H,5-17,38H2,1-4H3,(H,39,48)/t18-,19?,20?,21?,22?,23+,24+,25+,26-,27+,28-,29+,30+,31+,32+,33+,35-,36+,37-/m1/s1
InChIKeyRIPZNAKDQBCTCM-RFPABOQDSA-N
Species of MetaboliteComponentSourceComments
Microtetrasporaspecies (ncbitaxon:65473) - PubMed (9666174)
ChEBI Ontology
Outgoing Relation(s)
SCH 42282 (CHEBI:203635) is a oligosaccharide (CHEBI:50699)
IUPAC Name 
10-[(2S,3S,4S,5S,6R)-4-amino-3-[(2S,3S,4S,5R,6S)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-methyloxan-2-yl]oxy-3,7,11-triethyl-azacyclotetradecan-2-one
Manual XrefsDatabases
78445120ChemSpider