Chemical ID: 5200183

CCOC1C(C(C(C(O1)CO)O)O)O
Chemical ID:
5200183
Name [?]:
2-ethoxy-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
SMILES [?]:
CCOC1C(C(C(C(O1)CO)O)O)O
InChi [?]:
InChI=1/C8H16O6/c1-2-13-8-7(12)6(11)5(10)4(3-9)14-8/h4-12H,2-3H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,10,8,7,6,5,4,11,12,13,14,3,9/rA:14cCCOCCCCCOCOOOO/rB:s1;s2;s3;s4;s5;s6;s7;s4s8;s8;s10;s7;s6;s5;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H16O6
All Atoms:14
Heavy Atoms:14
Chiral Atoms:5
ZAP Information [?]
Total:2.65905
Area:368.707
Solvation:-6.55864
Coulombic:-84.1955
Bond Count [?]
All:14
Single:14
Double:0
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:208.209
H-Bond Donors:4
H-Bond Acceptors:6
XLogP:-1.61
LogP (Chemaxon):-1.14

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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