Chemical ID: 7712326

c1ccc(c(c1)C(=O)c2ccc3c4c2cccc4C(=O)OC3=O)C(=O)O
Chemical ID:
7712326
Name [?]:
None
SMILES [?]:
c1ccc(c(c1)C(=O)c2ccc3c4c2cccc4C(=O)OC3=O)C(=O)O
InChi [?]:
InChI=1/C20H10O6/c21-17(11-4-1-2-5-13(11)18(22)23)12-8-9-15-16-10(12)6-3-7-14(16)19(24)26-20(15)25/h1-9H,(H,22,23)
InChi Info:
AuxInfo=1/1/N:1,2,16,6,3,15,17,10,11,14,5,9,4,18,12,13,7,24,19,22,8,25,26,20,23,21/E:(22,23)/rA:26nCCCCCCCOCCCCCCCCCCCOOCOCOO/rB:s1;d2;s3;d4;d1s5;s5;d7;s7;s9;d10;s11;d12;d9s13;s14;d15;s16;s13d17;s18;d19;s19;s12s21;d22;s4;d24;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H10O6
All Atoms:36
Heavy Atoms:26
Chiral Atoms:None
ZAP Information [?]
Total:8.52727
Area:503.589
Solvation:-4.06246
Coulombic:-66.4172
Bond Count [?]
All:29
Single:17
Double:12
Rotors:3
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:3.96
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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