CHEBI:81878 - 15-Demethoxy-epsilon-rhodomycin

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ChEBI Name 15-Demethoxy-epsilon-rhodomycin
ChEBI ID CHEBI:81878
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C29H33NO11
Net Charge 0
Average Mass 571.57240
Monoisotopic Mass 571.20536
InChI InChI=1S/C29H33NO11/c1-5-29(39)10-15(41-16-9-13(30(3)4)23(32)11(2)40-16)18-19(22(29)28(37)38)27(36)20-21(26(18)35)25(34)17-12(24(20)33)7-6-8-14(17)31/h6-8,11,13,15-16,22-23,31-32,35-36,39H,5,9-10H2,1-4H3,(H,37,38)/t11-,13-,15-,16-,22-,23+,29+/m0/s1
InChIKey SDXUZQDREOXYJX-FUXNZPHBSA-N
SMILES CC[C@@]1(O)C[C@H](O[C@H]2C[C@@H]([C@H](O)[C@H](C)O2)N(C)C)c2c(O)c3C(=O)c4c(O)cccc4C(=O)c3c(O)c2[C@H]1C(O)=O
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via anthracycline )
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ChEBI Ontology
Outgoing 15-Demethoxy-epsilon-rhodomycin (CHEBI:81878) is a anthracycline (CHEBI:48120)
Manual Xref Database
C18641 KEGG COMPOUND
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