CHEBI:208348 - Nostotrebin 6

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Nostotrebin 6
ChEBI ID CHEBI:208348
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C50H38O10
Net Charge 0
Average Mass 798.844
Monoisotopic Mass 798.24650
InChI InChI=1S/C50H38O10/c51-35-13-1-29(2-14-35)25-41-42(26-30-3-15-36(52)16-4-30)46(58)49(45(41)57,33-9-21-39(55)22-10-33)50(34-11-23-40(56)24-12-34)47(59)43(27-31-5-17-37(53)18-6-31)44(48(50)60)28-32-7-19-38(54)20-8-32/h1-24,51-56H,25-28H2
InChIKey BIRIZXULSMAMOU-UHFFFAOYSA-N
SMILES O=C1C(=C(CC2=CC=C(O)C=C2)C(C1(C3=CC=C(O)C=C3)C4(C5=CC=C(O)C=C5)C(=O)C(CC6=CC=C(O)C=C6)=C(C4=O)CC7=CC=C(O)C=C7)=O)CC8=CC=C(O)C=C8
Metabolite of Species Details
Nostocspecies (NCBI:txid1180) See: PubMed
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.
(via diarylheptanoid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Nostotrebin 6 (CHEBI:208348) is a diarylheptanoid (CHEBI:78802)
IUPAC Name
2-(4-hydroxyphenyl)-2-[1-(4-hydroxyphenyl)-3,4-bis[(4-hydroxyphenyl)methyl]-2,5-dioxocyclopent-3-en-1-yl]-4,5-bis[(4-hydroxyphenyl)methyl]cyclopent-4-ene-1,3-dione
Manual Xref Database
78435989 ChemSpider
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