U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C22H24O6
Molecular Weight 384.4224
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of α-D-erythro-Pentopyranoside, methyl 2-deoxy-, bis(4-methylbenzoate)

SMILES

CO[C@@H]1C[C@H](OC(=O)C2=CC=C(C)C=C2)[C@@H](CO1)OC(=O)C3=CC=C(C)C=C3

InChI

InChIKey=UKFSGKLSXCFJNM-ZCNNSNEGSA-N
InChI=1S/C22H24O6/c1-14-4-8-16(9-5-14)21(23)27-18-12-20(25-3)26-13-19(18)28-22(24)17-10-6-15(2)7-11-17/h4-11,18-20H,12-13H2,1-3H3/t18-,19+,20-/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H24O6
Molecular Weight 384.4224
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:52:08 UTC 2023
Edited
by admin
on Sat Dec 16 19:52:08 UTC 2023
Record UNII
DHK26M66ZJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
α-D-erythro-Pentopyranoside, methyl 2-deoxy-, bis(4-methylbenzoate)
Systematic Name English
Decitabine Impurity 6
Common Name English
Code System Code Type Description
CAS
78185-66-7
Created by admin on Sat Dec 16 19:52:08 UTC 2023 , Edited by admin on Sat Dec 16 19:52:08 UTC 2023
PRIMARY
FDA UNII
DHK26M66ZJ
Created by admin on Sat Dec 16 19:52:08 UTC 2023 , Edited by admin on Sat Dec 16 19:52:08 UTC 2023
PRIMARY