CHEBI:227291 - Hiroshidine

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Hiroshidine
ChEBI ID CHEBI:227291
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C24H31NO9
Net Charge 0
Average Mass 477.510
Monoisotopic Mass 477.19988
InChI InChI=1S/C24H31NO9/c1-10(26)13-6-7-14(25(13)3)12-5-8-15(27)19-18(12)21(30)24-20(29)16(9-17(28)32-4)33-11(2)23(24,34-24)22(19)31/h5,8,10-11,13-14,16,20,22,26-27,29,31H,6-7,9H2,1-4H3/t10-,11+,13+,14+,16+,20-,22-,23?,24?/m0/s1
InChIKey OEVGTSXRJTXTAO-YKAORXRISA-N
SMILES O=C1C2=C(C(O)=CC=C2[C@@H]3N([C@@H]([C@@H](O)C)CC3)C)[C@H](O)C45C1(O4)[C@@H](O)[C@@H](CC(=O)OC)O[C@@H]5C
Metabolite of Species Details
Streptomyces hiroshimensis (NCBI:txid66424) See: PubMed
ChEBI Ontology
Outgoing Hiroshidine (CHEBI:227291) is a organic heterotricyclic compound (CHEBI:26979)
Hiroshidine (CHEBI:227291) is a organooxygen compound (CHEBI:36963)
IUPAC Name
methyl 2-[(9S,11R,13R,14S)-7,9,14-trihydroxy-4-[(2R,5R)-5-[(1S)-1-hydroxyethyl]-1-methylpyrrolidin-2-yl]-11-methyl-2-oxo-12,15-dioxatetracyclo[8.4.1.01,10.03,8]pentadeca-3,5,7-trien-13-yl]acetate