Chemical ID: 4236150

COc1ccccc1c2coc3cc(cc(c3c2=O)O)O
Chemical ID:
4236150
Name [?]:
5,7-dihydroxy-3-(2-methoxyphenyl)-chromen-4-one
SMILES [?]:
COc1ccccc1c2coc3cc(cc(c3c2=O)O)O
InChi [?]:
InChI=1/C16H12O5/c1-20-13-5-3-2-4-10(13)11-8-21-14-7-9(17)6-12(18)15(14)16(11)19/h2-8,17-18H,1H3
InChi Info:
AuxInfo=1/0/N:1,6,5,7,4,15,13,10,14,8,9,16,3,12,17,18,21,20,19,2,11/rA:21nCOCCCCCCCCOCCCCCCCOOO/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;d9;s10;s11;s12;d13;s14;d15;d12s16;s9s17;d18;s16;s14;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H12O5
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:5.59883
Area:447.43
Solvation:-5.58693
Coulombic:-53.6324
Bond Count [?]
All:23
Single:15
Double:8
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:284.263
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:2.64
LogP (Chemaxon):3.68

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Descriptor Annotations

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