CHEBI:200441 - 5-chlorobohemamine C

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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 5-chlorobohemamine C
ChEBI ID CHEBI:200441
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C14H19ClN2O3
Net Charge 0
Average Mass 298.770
Monoisotopic Mass 298.10842
InChI InChI=1S/C14H19ClN2O3/c1-7(2)5-11(19)16-10-6-9(18)14(4)13(20)12(15)8(3)17(10)14/h5-6,8,12-13,20H,1-4H3,(H,16,19)/t8-,12-,13+,14+/m0/s1
InChIKey XSOZVHIZNODJTJ-VGSLSFOHSA-N
SMILES Cl[C@@H]1[C@@H](O)[C@]2(C(=O)C=C(N2[C@H]1C)NC(=O)C=C(C)C)C
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: PubMed
ChEBI Ontology
Outgoing 5-chlorobohemamine C (CHEBI:200441) is a pyrrolizines (CHEBI:38522)
IUPAC Name
N-[(5S,6S,7S,8S)-6-chloro-7-hydroxy-5,8-dimethyl-1-oxo-6,7-dihydro-5H-pyrrolizin-3-yl]-3-methylbut-2-enamide
Manual Xref Database
10167410 ChemSpider
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