CHEBI:83849 - dalcochinin-8'-O-β-D-glucoside

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ChEBI Name dalcochinin-8'-O-β-D-glucoside
ChEBI ID CHEBI:83849
ChEBI ASCII Name dalcochinin-8'-O-beta-D-glucoside
Definition An organic heteropentacyclic compound that is the 8'-O-β-D-glucoside of dalcochinin.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
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Formula C29H34O12
Net Charge 0
Average Mass 574.57310
Monoisotopic Mass 574.20503
InChI InChI=1S/C29H34O12/c1-12(10-38-29-27(34)26(33)25(32)21(9-30)41-29)17-7-15-16(39-17)5-4-13-24(31)23-14-6-19(35-2)20(36-3)8-18(14)37-11-22(23)40-28(13)15/h4-6,8,17,21-27,29-34H,1,7,9-11H2,2-3H3/t17-,21-,22-,23+,24+,25-,26+,27-,29-/m1/s1
InChIKey YRUIPRJNLCHFCW-BZSZILPBSA-N
SMILES COc1cc2OC[C@H]3Oc4c5C[C@@H](Oc5ccc4[C@H](O)[C@H]3c2cc1OC)C(=C)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Metabolite of Species Details
Dalbergia cochinchinensis (NCBI:txid106130) Found in seed (BTO:0001226). See: DOI
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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing dalcochinin-8'-O-β-D-glucoside (CHEBI:83849) has role plant metabolite (CHEBI:76924)
dalcochinin-8'-O-β-D-glucoside (CHEBI:83849) is a β-D-glucoside (CHEBI:22798)
dalcochinin-8'-O-β-D-glucoside (CHEBI:83849) is a aromatic ether (CHEBI:35618)
dalcochinin-8'-O-β-D-glucoside (CHEBI:83849) is a olefinic compound (CHEBI:78840)
dalcochinin-8'-O-β-D-glucoside (CHEBI:83849) is a organic heteropentacyclic compound (CHEBI:38164)
dalcochinin-8'-O-β-D-glucoside (CHEBI:83849) is a oxacycle (CHEBI:38104)
dalcochinin-8'-O-β-D-glucoside (CHEBI:83849) is a secondary alcohol (CHEBI:35681)
IUPAC Name
2-[(2R,6R,6aR,12aS)-6-hydroxy-8,9-dimethoxy-1,2,6,6a,12,12a-hexahydrochromeno[3,4-b]furo[2,3-h]chromen-2-yl]prop-2-en-1-yl β-D-glucopyranoside
Synonym Source
Dalcochinin O-glucoside KNApSAcK
Manual Xrefs Databases
C00018877 KNApSAcK
CPD-9677 MetaCyc
View more database links
Registry Number Type Source
8246981 Reaxys Registry Number Reaxys
Last Modified
06 February 2015