CHEBI:132382 - tripfordine C

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ChEBI Name tripfordine C
ChEBI ID CHEBI:132382
Definition A sesquiterpene alkaloid with formula C36H45NO17, that is isolated from the root bark of Tripterygium hypoglaucum.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter qingping liu
Supplier Information
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Formula C36H45NO17
Net Charge 0
Average Mass 763.740
Monoisotopic Mass 763.26875
InChI InChI=1S/C36H45NO17/c1-15-16(2)31(44)53-28-26(50-19(5)40)30(52-21(7)42)35(14-47-17(3)38)29(51-20(6)41)25(49-18(4)39)24-27(43)36(35,34(28,9)46)54-33(24,8)13-48-32(45)23-12-37-11-10-22(15)23/h10-12,15-16,24-30,43,46H,13-14H2,1-9H3/t15?,16-,24-,25-,26+,27-,28+,29-,30+,33+,34+,35-,36+/m1/s1
InChIKey INDHYPIBEYIOOF-CSDGJUIDSA-N
SMILES [C@@H]1(C(O[C@@]2([C@](O)([C@@]34[C@H](O)[C@@]([H])([C@H]([C@H]([C@@]3([C@@H](OC(=O)C)[C@H]2OC(=O)C)COC(=O)C)OC(=O)C)OC(=O)C)[C@@](COC(C5=C(C1C)C=CN=C5)=O)(C)O4)C)[H])=O)C
Metabolite of Species Details
Tripterygium hypoglaucum (NCBI:txid205465) Found in root (BTO:0001188). See: PubMed
Tripterygium wilfordii (NCBI:txid458696) See: J. Nat. Prod., 69, (2006), 1271
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 tripfordine C (CHEBI:132382) has role plant metabolite (CHEBI:76924)
tripfordine C (CHEBI:132382) is a acetate ester (CHEBI:47622)
tripfordine C (CHEBI:132382) is a dihydroagarofuran sesquiterpenoid (CHEBI:71548)
tripfordine C (CHEBI:132382) is a macrolide (CHEBI:25106)
tripfordine C (CHEBI:132382) is a pyridine alkaloid (CHEBI:26416)
tripfordine C (CHEBI:132382) is a sesquiterpene alkaloid (CHEBI:26657)
Manual Xrefs Databases
101416498 PubChem
C00041946 KNApSAcK
View more database links
Registry Numbers Types Sources
18617394 Reaxys Registry Number Reaxys
911306-27-9 CAS Registry Number KNApSAcK
Citation Waiting for Citations Type Source
23252270 PubMed citation Europe PMC
Last Modified
07 November 2016