CHEBI:68065 - Ramonanin A, (rel)-

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ChEBI Name Ramonanin A, (rel)-
ChEBI ID CHEBI:68065
Definition A natural product found in Guaiacum officinale and Guaiacum sanctum.
Stars This entity has been manually annotated by a third party.
Supplier Information ZINC000064512333
Download Molfile XML SDF
Formula C40H40O10
Net Charge 0
Average Mass 680.73960
Monoisotopic Mass 680.26215
InChI InChI=1S/C40H40O10/c1-21-36(22-6-10-28(41)32(16-22)45-2)50-39(25-9-13-31(44)35(19-25)48-5)40(21)15-14-26-27(20-40)38(24-8-12-30(43)34(18-24)47-4)49-37(26)23-7-11-29(42)33(17-23)46-3/h6-13,16-19,36-39,41-44H,1,14-15,20H2,2-5H3/t36-,37-,38+,39-,40+/m0/s1
InChIKey GVLSMMAPMUCRRO-OQZGELFMSA-N
SMILES COc1cc(ccc1O)[C@H]1O[C@@H](c2ccc(O)c(OC)c2)[C@@]2(CCC3=C(C2)[C@H](O[C@H]3c2ccc(O)c(OC)c2)c2ccc(O)c(OC)c2)C1=C
Metabolite of Species Details
Guaiacum officinale (NCBI:txid374122) Found in heartwood (PO:0004512). CHCl3 extract of dried and powdered heart wood See: PubMed
Guaiacum sanctum (NCBI:txid45189) Found in heartwood (PO:0004512). 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.
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
(via diarylheptanoid )
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ChEBI Ontology
Outgoing Ramonanin A, (rel)- (CHEBI:68065) has role metabolite (CHEBI:25212)
Ramonanin A, (rel)- (CHEBI:68065) is a diarylheptanoid (CHEBI:78802)
Synonym Source
rel-4,4',4'',4'''-[(1S,2'S,3R,5R,5'R)-4'-Methylene-1,4,4',5',6,7-hexahydro-3H-spiro[2-benzofuran-5,3'-furan]-1,2',3,5'-tetrayl]tetrakis(2-methoxyphenol) ChEBI
Citation Type Source
21391655 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:phenols(CHEBI:33853); ISA:methoxybenzene(CHEBI:51683); ISA:aromatic ether(CHEBI:35618); ISA:dihydrofuran(CHEBI:51659); ISA:oxolanes(CHEBI:26912); ISA:polyol(CHEBI:26191); ISA:ether(CHEBI:25698); ISA:aromatic alcohol(CHEBI:33854);