CHEBI:221700 - Pyroclavine

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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 Pyroclavine
ChEBI ID CHEBI:221700
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H20N2
Net Charge 0
Average Mass 240.350
Monoisotopic Mass 240.16265
InChI InChI=1S/C16H20N2/c1-10-6-13-12-4-3-5-14-16(12)11(8-17-14)7-15(13)18(2)9-10/h3-5,8,10,13,15,17H,6-7,9H2,1-2H3/t10-,13+,15+/m0/s1
InChIKey VLMZMRDOMOGGFA-PSOPSSQASA-N
SMILES N1([C@H]2[C@@H](C3=C4C(=CC=C3)NC=C4C2)C[C@@H](C1)C)C
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 alkaloid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Pyroclavine (CHEBI:221700) is a alkaloid (CHEBI:22315)
IUPAC Name
(6aR,9S,10aR)-7,9-dimethyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-g]quinoline
Manual Xref Database
2340761 ChemSpider
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