Chemical ID: 6914825

C1C(C(C(C(O1)OCC2C(C(C(C(O2)O)O)O)O)O)O)O
Chemical ID:
6914825
Name [?]:
6-[(3,4,5-trihydroxytetrahydropyran-2-yl)oxymethyl]tetrahydropyran-2,3,4,5-tetrol
SMILES [?]:
C1C(C(C(C(O1)OCC2C(C(C(C(O2)O)O)O)O)O)O)O
InChi [?]:
InChI=1/C11H20O10/c12-3-1-19-11(9(17)5(3)13)20-2-4-6(14)7(15)8(16)10(18)21-4/h3-18H,1-2H2
InChi Info:
AuxInfo=1/0/N:1,8,2,9,3,10,11,12,4,13,5,21,20,18,17,16,19,15,6,7,14/rA:21cCCCCCOOCCCCCCOOOOOOOO/rB:s1;s2;s3;s4;s1s5;s5;s7;s8;s9;s10;s11;s12;s9s13;s13;s12;s11;s10;s4;s3;s2;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H20O10
All Atoms:41
Heavy Atoms:21
Chiral Atoms:9
ZAP Information [?]
Total:2.96267
Area:484.401
Solvation:-9.14734
Coulombic:-145.426
Bond Count [?]
All:22
Single:22
Double:0
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:312.271
H-Bond Donors:7
H-Bond Acceptors:10
XLogP:-3.63
LogP (Chemaxon):-2.6

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Descriptor Annotations

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