CHEBI:80017 - Lankamycin

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ChEBI Name Lankamycin
ChEBI ID CHEBI:80017
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C42H72O16
Net Charge 0
Average Mass 833.01150
Monoisotopic Mass 832.48204
InChI InChI=1S/C42H72O16/c1-19-17-41(12,49)37(47)24(6)35(54-28(10)44)23(5)34(21(3)26(8)43)57-39(48)25(7)36(22(4)33(19)58-40-32(46)30(50-14)16-20(2)52-40)56-31-18-42(13,51-15)38(27(9)53-31)55-29(11)45/h19-27,30-36,38,40,43,46,49H,16-18H2,1-15H3/t19-,20+,21-,22+,23-,24+,25+,26-,27-,30-,31-,32+,33-,34+,35-,36-,38+,40-,41-,42+/m0/s1
InChIKey JQMACDQCTNFQMM-QAOHEUSVSA-N
SMILES CO[C@H]1C[C@@H](C)O[C@@H](O[C@H]2[C@@H](C)C[C@](C)(O)C(=O)[C@H](C)[C@@H](OC(C)=O)[C@@H](C)[C@H](OC(=O)[C@H](C)[C@@H](O[C@H]3C[C@@](C)(OC)[C@H](OC(C)=O)[C@H](C)O3)[C@@H]2C)[C@@H](C)[C@H](C)O)[C@@H]1O
ChEBI Ontology
Outgoing Lankamycin (CHEBI:80017) is a macrolide (CHEBI:25106)
Manual Xrefs Databases
C00018774 KNApSAcK
C15679 KEGG COMPOUND
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Registry Number Type Source
30042-37-6 CAS Registry Number KEGG COMPOUND