CHEBI:176054 - Leptophylloside

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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 Leptophylloside
ChEBI ID CHEBI:176054
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C20H24O10
Net Charge 0
Average Mass 424.402
Monoisotopic Mass 424.13695
InChI InChI=1S/C20H24O10/c1-20(2,30-19-15(25)14(24)13(23)10(7-21)27-19)11-6-9-5-8-3-4-12(22)29-17(8)16(26)18(9)28-11/h3-5,10-11,13-15,19,21,23-26H,6-7H2,1-2H3/t10-,11-,13-,14+,15-,19+/m1/s1
InChIKey QZUDEXAHKXCIDG-NUUDRHLNSA-N
SMILES O(C([C@@]1(OC2=C(C1)C=C3C(OC(=O)C=C3)=C2O)[H])(C)C)[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)CO
ChEBI Ontology
Outgoing Leptophylloside (CHEBI:176054) is a psoralens (CHEBI:26369)
IUPAC Name
(2R)-9-hydroxy-2-[2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl]-2,3-dihydrouro[3,2-g]chromen-7-one
Manual Xref Database
161478 ChemSpider
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Registry Number Type Source
53846-51-8 CAS Registry Number ChemIDplus