Chemical ID: 6671688

C(C(C(C(C(C(=O)[O-])O)O)O)O)OP(=O)([O-])[O-]
Chemical ID:
6671688
Name [?]:
2,3,4,5-tetrahydroxy-6-phosphonatooxy-hexanoate
SMILES [?]:
C(C(C(C(C(C(=O)[O-])O)O)O)O)OP(=O)([O-])[O-]
InChi [?]:
InChI=1/C6H13O10P/c7-2(1-16-17(13,14)15)3(8)4(9)5(10)6(11)12/h2-5,7-10H,1H2,(H,11,12)(H2,13,14,15)/p-3
InChi Info:
AuxInfo=1/1/N:1,2,3,4,5,6,12,11,10,9,7,8,15,16,17,13,14/E:(11,12)(13,14,15)/rA:17cCCCCCCOO-OOOOOPOO-O-/rB:s1;s2;s3;s4;s5;d6;s6;s5;s4;s3;s2;s1;s13;d14;s14;s14;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C6H10O10P-3
All Atoms:17
Heavy Atoms:17
Chiral Atoms:4
ZAP Information [?]
Total:-203.358
Area:427.907
Solvation:-214.056
Coulombic:42.8459
Bond Count [?]
All:16
Single:14
Double:2
Rotors:7
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:273.111
H-Bond Donors:4
H-Bond Acceptors:10
XLogP:-5.45
LogP (Chemaxon):-2.88

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Descriptor Annotations

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