Chemical ID: 5235726

C(C1C(C(C(O1)n2c(=O)[nH]c(=O)o2)O)O)O
Chemical ID:
5235726
Name [?]:
2-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1,2,4-oxadiazolidine-3,5-dione
SMILES [?]:
C(C1C(C(C(O1)n2c(=O)[nH]c(=O)o2)O)O)O
InChi [?]:
InChI=1/C7H10N2O7/c10-1-2-3(11)4(12)5(15-2)9-6(13)8-7(14)16-9/h2-5,10-12H,1H2,(H,8,13,14)
InChi Info:
AuxInfo=1/1/N:1,2,3,4,5,8,11,10,7,16,15,14,9,12,6,13/rA:16cCCCCCONCONCOOOOO/rB:s1;s2;s3;s4;s2s5;s5;s7;d8;s8;s10;d11;s7s11;s4;s3;s1;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H10N2O7
All Atoms:16
Heavy Atoms:16
Chiral Atoms:4
ZAP Information [?]
Total:2.29142
Area:376.264
Solvation:-7.11518
Coulombic:-99.4543
Bond Count [?]
All:17
Single:15
Double:2
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:234.164
H-Bond Donors:3
H-Bond Acceptors:6
XLogP:-2.53
LogP (Chemaxon):-1.22

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Descriptor Annotations

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