CHEBI:132388 - hyponine D

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ChEBI Name hyponine D
ChEBI ID CHEBI:132388
Definition A sesquiterpene alkaloid that is isolated from Tripterygium hypoglaucum.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter qingping liu
Supplier Information
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Formula C47H50N2O18
Net Charge 0
Average Mass 930.904
Monoisotopic Mass 930.30586
InChI InChI=1S/C47H50N2O18/c1-23-24(2)40(54)66-37-35(64-42(56)30-16-12-18-48-20-30)39(63-28(6)53)46(22-59-25(3)50)38(62-27(5)52)34(61-26(4)51)32-36(65-41(55)29-14-10-9-11-15-29)47(46,45(37,8)58)67-44(32,7)21-60-43(57)31-17-13-19-49-33(23)31/h9-20,23-24,32,34-39,58H,21-22H2,1-8H3/t23?,24?,32-,34-,35+,36-,37+,38-,39+,44+,45+,46-,47+/m1/s1
InChIKey BDKQPFFHSCFTQW-UWRKWEHLSA-N
SMILES C1(C(O[C@@]2([C@](O)([C@@]34[C@H](OC(=O)C=5C=CC=CC5)[C@@]([H])([C@H]([C@H]([C@@]3([C@@H](OC(=O)C)[C@H]2OC(C=6C=NC=CC6)=O)COC(=O)C)OC(=O)C)OC(C)=O)[C@@](COC(C7=C(C1C)N=CC=C7)=O)(C)O4)C)[H])=O)C
Metabolite of Species Details
Tripterygium hypoglaucum (NCBI:txid205465) See: Phytochemistry 52 (1999) 1735-1738
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via alkaloid )
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ChEBI Ontology
Outgoing hyponine D (CHEBI:132388) has functional parent nicotinic acid (CHEBI:15940)
hyponine D (CHEBI:132388) has role plant metabolite (CHEBI:76924)
hyponine D (CHEBI:132388) is a acetate ester (CHEBI:47622)
hyponine D (CHEBI:132388) is a benzoate ester (CHEBI:36054)
hyponine D (CHEBI:132388) is a dihydroagarofuran sesquiterpenoid (CHEBI:71548)
hyponine D (CHEBI:132388) is a macrolide (CHEBI:25106)
hyponine D (CHEBI:132388) is a pyridine alkaloid (CHEBI:26416)
hyponine D (CHEBI:132388) is a sesquiterpene alkaloid (CHEBI:26657)
Synonym Source
hyponin D ChEBI
Manual Xref Database
C00039395 KNApSAcK
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Registry Numbers Types Sources
259823-31-9 CAS Registry Number KNApSAcK
8671241 Reaxys Registry Number Reaxys
Last Modified
13 July 2016