MW: 500.46
CAS: 97938-28-8
MDL: MFCD09699779
TNP: TNP00627
LogP: 0.87
LogS: -3.07
Acceptors: 13
Donors: 6
Rotation Bonds: 12
Chiral Centers: 10
N+O: 13
LIPINSKY: 2
IUPAC: 6-methoxy-7-{3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyl(2H-3,4,5,6-tetrahy dropyran-2-yloxy))methyl](2H-3,4,5,6-tetrahydropyran-2-yl)oxy}chromen-2-one
Smiles: O(C1C(C(O)C(O)C(C)O1)O)CC1OC(C(C(C1O)O)O)Oc1cc2oc(ccc2cc1OC)=O
SOURCE: A coumarin glycoside from Haplophyllum perforatum
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