ISOMALT

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Synonyms
Status
Molecule Category Free-form
UNII S870P55O2W
EPA CompTox DTXSID8020753

Structure

InChI Key SERLAGPUMNYUCK-BLEZHGCXSA-N
Smiles OCC(O)[C@@H](O)[C@H](O)[C@H](O)CO[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChI
InChI=1S/C12H24O11/c13-1-4(15)7(17)8(18)5(16)3-22-12-11(21)10(20)9(19)6(2-14)23-12/h4-21H,1-3H2/t4?,5-,6-,7-,8-,9-,10+,11-,12+/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C12H24O11
Molecular Weight 344.31
AlogP -5.76
Hydrogen Bond Acceptor 11.0
Hydrogen Bond Donor 9.0
Number of Rotational Bond 8.0
Polar Surface Area 200.53
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 23.0

Related Entries

Cross References

Resources Reference
ChEBI 140428
ChEMBL CHEMBL2104398
FDA SRS S870P55O2W
SureChEMBL SCHEMBL1781066
CONTENTS