CHEBI:29624 - Megalomicin A

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ChEBI Name Megalomicin A
ChEBI ID CHEBI:29624
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C44H80N2O15
Net Charge 0
Average Mass 877.112
Monoisotopic Mass 876.55587
InChI InChI=1S/C44H80N2O15/c1-16-30-44(11,54)37(50)23(4)33(47)21(2)19-43(10,61-31-18-29(46(14)15)34(48)26(7)56-31)39(60-41-35(49)28(45(12)13)17-22(3)55-41)24(5)36(25(6)40(52)58-30)59-32-20-42(9,53)38(51)27(8)57-32/h21-32,34-39,41,48-51,53-54H,16-20H2,1-15H3/t21-,22-,23+,24+,25-,26+,27+,28+,29-,30-,31+,32+,34+,35-,36+,37-,38+,39-,41+,42-,43-,44-/m1/s1
InChIKey LRWRQTMTYVZKQW-WWDNQWNISA-N
SMILES CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(O)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@@](C)(C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O)O[C@H]1C[C@H]([C@@H](O)[C@H](C)O1)N(C)C
ChEBI Ontology
Outgoing Megalomicin A (CHEBI:29624) is a amino oligosaccharide (CHEBI:22483)
Synonym Source
Megalomicin A KEGG COMPOUND
Manual Xref Database
C11985 KEGG COMPOUND
View more database links
Registry Number Type Source
28022-11-9 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014