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Compound: 5546
Plants: 312
References: 992
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moracin M
ScientificNameLabel
moracin M
PHCD compound ID :
3446
Chemical Names :
moracin M
Molecular Formula :
C14H10O4
Molecular Weight :
242.057909
More Details :
Names & Synonyms:
5-(6-hydroxybenzofuran-2-yl)benzene-1,3-diol , 5-(6-hydroxy-2-benzofuranyl)benzene-1,3-diol , 5-(6-hydroxy-1-benzofuran-2-yl)benzene-1,3-diol , 5-(6-oxidanyl-1-benzofuran-2-yl)benzene-1,3-diol , 5-(6-hydroxybenzofuran-2-yl)resorcinol
Smiles:
Oc1cc(O)cc(c1)c1oc2c(c1)ccc(c2)O
InChi :
InChI=1S/C14H10O4/c15-10-2-1-8-5-13(18-14(8)7-10)9-3-11(16)6-12(17)4-9/h1-7,15-17H
InChi Key :
InChIKey=LHPRYOJTASOZGJ-UHFFFAOYSA-N
PubChem ID :
185848
Rotatable bond count :
1
Rule of five :
0
Hydrogen bond acceptor count :
4
Ionization potential :
8.726703
Hydrogen bond donor count :
3
Electric dipole moment :
1.777
XLogP :
1.524
VDW volume :
197.636563
Molecular weight :
242.057909
HOMO-LUMO gap :
7.757000
Herb list :
Royal mulberry, Black mulberry - Morus nigra - شاه توت، شاتوت
Refrences & Litretures:
482. Journal:'J. Agric. Food Chem' Year:'2010' Volume:'58' Page:'5368' DOI:'10.1021/jf1003607' Title:'Tyrosinase Inhibitory Constituents from the Roots of Morus nigra: A Structure-Activity Relationship Study'
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