CHEBI:81421 - Spenolimycin

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ChEBI Name Spenolimycin
ChEBI ID CHEBI:81421
Stars This entity has been manually annotated by a third party.
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Formula C15H26N2O7
Net Charge 0
Average Mass 346.37610
Monoisotopic Mass 346.17400
InChI InChI=1S/C15H26N2O7/c1-6-5-7(21-4)15(20)14(22-6)23-13-11(19)8(16-2)10(18)9(17-3)12(13)24-15/h5-6,8-14,16-20H,1-4H3/t6-,8-,9+,10+,11+,12-,13-,14+,15+/m1/s1
InChIKey JXUOVTMVWNHOAJ-XLBYJKOOSA-N
SMILES CN[C@@H]1[C@H](O)[C@H](NC)[C@H]2O[C@]3(O)[C@@H](O[C@H](C)C=C3OC)O[C@@H]2[C@H]1O
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing Spenolimycin (CHEBI:81421) is a primary aliphatic amine (CHEBI:17062)
Manual Xref Database
C17970 KEGG COMPOUND
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Registry Number Type Source
95041-97-7 CAS Registry Number KEGG COMPOUND