CHEBI:29625 - Megalomicin B

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ChEBI Name Megalomicin B
ChEBI ID CHEBI:29625
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C46H82N2O16
Net Charge 0
Average Mass 919.149
Monoisotopic Mass 918.56643
InChI InChI=1S/C46H82N2O16/c1-17-32-46(12,56)39(53)24(4)35(50)22(2)20-45(11,64-33-19-31(48(15)16)36(51)27(7)58-33)40(63-43-37(52)30(47(13)14)18-23(3)57-43)25(5)38(26(6)42(54)61-32)62-34-21-44(10,55)41(28(8)59-34)60-29(9)49/h22-28,30-34,36-41,43,51-53,55-56H,17-21H2,1-16H3/t22-,23-,24+,25+,26-,27+,28+,30+,31-,32-,33+,34+,36+,37-,38+,39-,40-,41+,43+,44-,45-,46-/m1/s1
InChIKey WJOASKOPJZDBAH-WKBCHECCSA-N
SMILES CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(O)[C@@H](OC(C)=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 B (CHEBI:29625) is a amino oligosaccharide (CHEBI:22483)
Synonym Source
Megalomicin B KEGG COMPOUND
Manual Xref Database
C11986 KEGG COMPOUND
View more database links
Registry Number Type Source
49669-75-2 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014