Details of the Drug

General Information of Drug (ID: DMVWUCF)

Drug Name
Sucrose
Synonyms
sucrose; saccharose; 57-50-1; Cane sugar; sugar; Table sugar; White sugar; D-Sucrose; Saccharum; Rohrzucker; Amerfand; Sucrose, pure; Sucrose, dust; D(+)-Saccharose; sacarosa; D(+)-Sucrose; D-(+)-Saccharose; beta-D-Fructofuranosyl alpha-D-glucopyranoside; Microse; Amerfond; Granulated sugar; Rock candy; Beet sugar; Sucraloxum [INN-Latin]; beta-D-Fructofuranosyl-alpha-D-glucopyranoside; Confectioner's sugar; HSDB 500; Sacharose; CCRIS 2120; Sucrose [USAN:JAN]; alpha-D-Glucopyranosyl beta-D-fructofuranoside; CHEBI:17992; D-Saccharose
Indication
Disease Entry ICD 11 Status REF
Discovery agent N.A. Investigative [1]
Drug Type
Small molecular drug
Structure
3D MOL 2D MOL
#Ro5 Violations (Lipinski): 3 Molecular Weight (mw) 342.3
Logarithm of the Partition Coefficient (xlogp) -3.7
Rotatable Bond Count (rotbonds) 5
Hydrogen Bond Donor Count (hbonddonor) 8
Hydrogen Bond Acceptor Count (hbondacc) 11
Chemical Identifiers
Formula
C12H22O11
IUPAC Name
(2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
Canonical SMILES
C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@]2([C@H]([C@@H]([C@H](O2)CO)O)O)CO)O)O)O)O
InChI
InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1
InChIKey
CZMRCDWAGMRECN-UGDNZRGBSA-N
Cross-matching ID
PubChem CID
5988
ChEBI ID
CHEBI:17992
CAS Number
57-50-1
DrugBank ID
DB02772
TTD ID
D08TCV
VARIDT ID
DR00131
INTEDE ID
DR2151
Combinatorial Drugs (CBD) Click to Jump to the Detailed CBD Information of This Drug

Molecular Interaction Atlas of This Drug


Drug Therapeutic Target (DTT)
DTT Name DTT ID UniProt ID MOA REF
Staphylococcus Beta-lactamase (Stap-coc blaZ) TTHI19T BLAC_STAAU Inhibitor [2]

Drug Transporter (DTP)
DTP Name DTP ID UniProt ID MOA REF
Solute carrier family 45 member 4 (SLC45A4) DTKPHZ6 S45A4_HUMAN Substrate [3]
Solute carrier family 45 member 3 (SLC45A3) DTGEFXH S45A3_HUMAN Substrate [4]
Membrane-associated transporter protein (SLC45A2) DTNCJAT S45A2_HUMAN Substrate [5]

Drug-Metabolizing Enzyme (DME)
DME Name DME ID UniProt ID MOA REF
Fructokinase (scrK) DEBW1FU SCRK_FUSMR Substrate [6]
Sucrose phosphorylase (Spase) DEJ4FO2 A0A0M4N1J6_BIFLN Substrate [7]
Glucansucrase (gtf106B) DEWRN24 Q5SBN3_LACRE Substrate [8], [9]
Beta-fructofuranosidase (BFRU) DECWNTP E1CPU3_BIFLN Substrate [7]
Sucrose-6-phosphate hydrolase scrB (ScrB) DEICTXP B0MAC0_ANACD Substrate [7]

Drug Off-Target (DOT)
DOT Name DOT ID UniProt ID Interaction REF
Fibroblast growth factor 2 (FGF2) OT7YUJ9F FGF2_HUMAN Gene/Protein Processing [10]
Insulin (INS) OTZ85PDU INS_HUMAN Gene/Protein Processing [11]
Neurotensin/neuromedin N (NTS) OTPGDNQS NEUT_HUMAN Gene/Protein Processing [12]
Proheparin-binding EGF-like growth factor (HBEGF) OTLU00JS HBEGF_HUMAN Gene/Protein Processing [10]
Sex hormone-binding globulin (SHBG) OTPWU5IW SHBG_HUMAN Gene/Protein Processing [13]
Molecular Interaction Atlas (MIA) Jump to Detail Molecular Interaction Atlas of This Drug

References

1 URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 5411).
2 Ten S, Maclaren N: Insulin resistance syndrome in children. J Clin Endocrinol Metab. 2004 Jun;89(6):2526-39.
3 The SLC45 gene family of putative sugar transporters. Mol Aspects Med. 2013 Apr-Jun;34(2-3):655-60.
4 Putative role of the H(+)/sucrose symporter SLC45A3 as an osmolyte transporter in the kidney. Pflugers Arch. 2016 Aug;468(8):1353-62.
5 Identification of amino acids important for substrate specificity in sucrose transporters using gene shuffling. J Biol Chem. 2012 Aug 31;287(36):30296-304.
6 Sugar metabolism by fusobacteria: regulation of transport, phosphorylation, and polymer formation by Fusobacterium mortiferum ATCC 25557. Infect Immun. 1991 Dec;59(12):4547-54.
7 Characterization of fructooligosaccharide-degrading enzymes in human commensal Bifidobacterium longum and Anaerostipes caccae. Biochem Biophys Res Commun. 2019 Oct 15;518(2):294-298.
8 Biosolids application affects the competitive sorption and lability of cadmium, copper, nickel, lead, and zinc in fluvial and calcareous soils. Environ Geochem Health. 2017 Dec;39(6):1365-1379.
9 Growth and tolerance of term infants fed formula with probiotic lactobacillus reuteri. Clin Pediatr (Phila). 2015 Oct;54(12):1175-84.
10 Osmotic Induction of Angiogenic Growth Factor Expression in Human Retinal Pigment Epithelial Cells. PLoS One. 2016 Jan 22;11(1):e0147312. doi: 10.1371/journal.pone.0147312. eCollection 2016.
11 Immunoreactive beta-endorphin increases after an aspartame chocolate drink in healthy human subjects. Physiol Behav. 1991 Nov;50(5):941-4. doi: 10.1016/0031-9384(91)90418-n.
12 Protein kinase C inhibitors alter neurotensin receptor binding and function in prostate cancer PC3 cells. Regul Pept. 2008 Apr 10;147(1-3):96-109. doi: 10.1016/j.regpep.2008.01.009. Epub 2008 Feb 11.
13 Monosaccharide-induced lipogenesis regulates the human hepatic sex hormone-binding globulin gene. J Clin Invest. 2007 Dec;117(12):3979-87. doi: 10.1172/JCI32249.