CHEBI:10 - (+)-Atherospermoline

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ChEBI Name (+)-Atherospermoline
ChEBI ID CHEBI:10
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C36H38N2O6
Net Charge 0
Average Mass 594.698
Monoisotopic Mass 594.27299
InChI InChI=1S/C36H38N2O6/c1-37-13-11-23-18-31(41-3)32-20-26(23)27(37)15-21-5-8-25(9-6-21)43-30-17-22(7-10-29(30)39)16-28-34-24(12-14-38(28)2)19-33(42-4)35(40)36(34)44-32/h5-10,17-20,27-28,39-40H,11-16H2,1-4H3/t27-,28-/m0/s1
InChIKey XGEAUXVPBXUBKN-NSOVKSMOSA-N
SMILES COc1cc2CCN(C)[C@H]3Cc4ccc(Oc5cc(C[C@@H]6N(C)CCc7cc(OC)c(O)c(Oc1cc23)c67)ccc5O)cc4
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 (+)-Atherospermoline (CHEBI:10) is a bisbenzylisoquinoline alkaloid (CHEBI:133004)
Synonym Source
(+)-Atherospermoline KEGG COMPOUND
Manual Xrefs Databases
C00001814 KNApSAcK
C11141 KEGG COMPOUND
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Registry Number Type Source
21008-67-3 CAS Registry Number KEGG COMPOUND
Last Modified
12 August 2016