Chemical ID: 6047556

c1cc(c(cc1c2coc3cc(ccc3c2=O)O)O)O
Chemical ID:
6047556
Name [?]:
3-(3,4-dihydroxyphenyl)-7-hydroxy-chromen-4-one
SMILES [?]:
c1cc(c(cc1c2coc3cc(ccc3c2=O)O)O)O
InChi [?]:
InChI=1/C15H10O5/c16-9-2-3-10-14(6-9)20-7-11(15(10)19)8-1-4-12(17)13(18)5-8/h1-7,16-18H
InChi Info:
AuxInfo=1/0/N:1,13,14,2,5,11,8,6,12,15,7,3,4,10,16,18,20,19,17,9/rA:20nCCCCCCCCOCCCCCCCOOOO/rB:s1;d2;s3;d4;d1s5;s6;d7;s8;s9;s10;d11;s12;d13;d10s14;s7s15;d16;s12;s4;s3;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H10O5
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:5.93012
Area:438.592
Solvation:-5.03469
Coulombic:-63.5263
Bond Count [?]
All:22
Single:14
Double:8
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:270.237
H-Bond Donors:3
H-Bond Acceptors:4
XLogP:1.9
LogP (Chemaxon):3.0

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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