CHEBI:67354 - vandateroside I, (-)-

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ChEBI Name vandateroside I, (-)-
ChEBI ID CHEBI:67354
Definition A natural product found in Vanda teres.
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C24H28O12
Net Charge 0
Average Mass 508.47190
Monoisotopic Mass 508.15808
InChI InChI=1S/C24H28O12/c25-11-17-19(28)20(29)21(30)22(36-17)35-16-7-3-14(4-8-16)12-34-18(27)10-24(33,23(31)32)9-13-1-5-15(26)6-2-13/h1-8,17,19-22,25-26,28-30,33H,9-12H2,(H,31,32)/t17-,19-,20+,21-,22-,24-/m1/s1
InChIKey LQXFPSIXNFKWHE-UINIGASKSA-N
SMILES OC[C@H]1O[C@@H](Oc2ccc(COC(=O)C[C@](O)(Cc3ccc(O)cc3)C(O)=O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Metabolite of Species Details
Vanda teres (NCBI:txid339107) Found in root (BTO:0001188). Methanolic extract of dried stems See: PubMed
Vanda teres (NCBI:txid339107) Found in leaf (BTO:0000713). Methanolic extract of dried stems See: PubMed
Vanda teres (NCBI:txid339107) Found in stem (BTO:0001300). Methanolic extract of dried stems See: PubMed
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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing vandateroside I, (-)- (CHEBI:67354) has role metabolite (CHEBI:25212)
vandateroside I, (-)- (CHEBI:67354) is a glycoside (CHEBI:24400)
Synonyms Sources
(-)-4-(4'-beta-D-glucopyranosyloxybenzyl)-2-(p-hydroxybenzyl)malate ChEBI
(-)-4-(4'-beta-D-glucopyranosyloxybenzyl)-eucomate ChEBI
(2R)-4-{[4-(beta-D-Glucopyranosyloxy)benzyl]oxy}-2-hydroxy-2-(4-hydroxybenzyl)-4-oxobutanoic acid ChEBI
Citation Waiting for Citations Type Source
21510636 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:disaccharide(CHEBI:36233); ISA:monocarboxylic acid(CHEBI:25384); ISA:carboxylic ester(CHEBI:33308); HFP:benzyl alcohol(CHEBI:17987); ISA:benzyl ether(CHEBI:59859); ISA:aromatic ether(CHEBI:35618); ISA:fatty acid ester(CHEBI:35748); ISA:L-alpha-D-Hepp-(1->7)-L-alpha-D-Hepp-(1->3)-L-alpha-D-Hepp-(1->5)-alpha-Kdo(CHEBI:78618); ISA:3-hydroxy carboxylic acid(CHEBI:61355); ISA:phenols(CHEBI:33853); ISA:oxanes(CHEBI:46942); ISA:hydroxy monocarboxylic acid(CHEBI:35868); ISA:dicarboxylic acid(CHEBI:35692); ISA:tertiary alcohol(CHEBI:26878); ISA:polyol(CHEBI:26191); ISA:secondary alcohol(CHEBI:35681); ISA:organonitrogen compound(CHEBI:35352); ISA:carboxylic acid(CHEBI:33575); ISA:acetal(CHEBI:59769); ISA:carbonyl compound(CHEBI:36586); ISA:aromatic alcohol(CHEBI:33854); ISA:primary alcohol(CHEBI:15734);