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ethyl-ITP

Go to external page http://purl.obolibrary.org/obo/CHEBI_62907

An organic triphosphate formed by condensation between the gamma-phospho group of inosine 5'-triphosphate and ethanol.

Term info

Label

ethyl-ITP

database cross reference
Subsets

3_STAR

charge

0

formula

C12H19N4O14P3

has obo namespace

chebi_ontology

has related synonym

monoethyl uridine-triphosphate, gamma-monoethyl inosine triphosphate, gamma-ethyl inosine triphosphate, ethyl inosine triphosphate, inosine 5'-(P(3)-ethyl trihydrogen triphosphate)

id

CHEBI:62907

inchi

InChI=1S/C12H19N4O14P3/c1-2-26-31(20,21)29-33(24,25)30-32(22,23)27-3-6-8(17)9(18)12(28-6)16-5-15-7-10(16)13-4-14-11(7)19/h4-6,8-9,12,17-18H,2-3H2,1H3,(H,20,21)(H,22,23)(H,24,25)(H,13,14,19)/t6-,8-,9-,12-/m1/s1

inchikey

SNWFDFGDCIOJBQ-WOUKDFQISA-N

mass

536.21890

monoisotopicmass

536.01106

smiles

CCOP(O)(=O)OP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c1nc[nH]c2=O