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CHEBI:17010 - S-inosyl-L-homocysteine

ChEBI IDCHEBI:17010
ChEBI NameS-inosyl-L-homocysteine
Stars
ASCII NameS-inosyl-L-homocysteine
DefinitionL-homocysteine substituted at sulfur by a 5'-deoxyinosin-5'-yl group.
Secondary ChEBI IDsCHEBI:8961, CHEBI:12747, CHEBI:22053
Last Modified28 July 2014
DownloadsMolfile
FormulaC14H19N5O6S
Net Charge0
Average Mass385.402
Monoisotopic Mass385.10560
SMILESN[C@@H](CCSC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O)C(=O)O
InChIInChI=1S/C14H19N5O6S/c15-6(14(23)24)1-2-26-3-7-9(20)10(21)13(25-7)19-5-18-8-11(19)16-4-17-12(8)22/h4-7,9-10,13,20-21H,1-3,15H2,(H,23,24)(H,16,17,22)/t6-,7+,9+,10+,13+/m0/s1
InChIKeyVNPWVMVYUSNFAW-WFMPWKQPSA-N
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
S-inosyl-L-homocysteine (CHEBI:17010) is a homocysteines (CHEBI:24610)
S-inosyl-L-homocysteine (CHEBI:17010) is tautomer of S-inosyl-L-homocysteine zwitterion (CHEBI:57985)
Incoming Relation(s)
S-inosyl-L-homocysteine zwitterion (CHEBI:57985) is tautomer of S-inosyl-L-homocysteine (CHEBI:17010)
IUPAC Name 
S-(5'-deoxyinosin-5'-yl)-L-homocysteine
Synonym  Source
S-Inosyl-L-homocysteineKEGG COMPOUND
Manual XrefsDatabases
C03431KEGG COMPOUND
SIBPDBeChem
Registry NumbersSources
Beilstein:1185800Beilstein