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

Details

Stereochemistry ABSOLUTE
Molecular Formula C6H12O4
Molecular Weight 148.1571
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIGITOXOSE

SMILES

C[C@@H](O)[C@@H](O)[C@@H](O)CC=O

InChI

InChIKey=JWFRNGYBHLBCMB-NGJCXOISSA-N
InChI=1S/C6H12O4/c1-4(8)6(10)5(9)2-3-7/h3-6,8-10H,2H2,1H3/t4-,5+,6-/m1/s1

HIDE SMILES / InChI

Molecular Formula C6H12O4
Molecular Weight 148.1571
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
Substance Class Chemical
Created
by admin
on Sat Dec 16 09:13:04 GMT 2023
Edited
by admin
on Sat Dec 16 09:13:04 GMT 2023
Record UNII
A4R5906C56
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIGITOXOSE
MI  
Common Name English
NSC-87513
Code English
2,6-DIDEOXY-D-ALTROSE
Systematic Name English
DIGITOXOSE [MI]
Common Name English
D-DIGITOXOSE
Common Name English
(+)-DIGITOXOSE
Common Name English
2,6-DIDEOXY-D-RIBO-HEXOSE
Systematic Name English
D-RIBO-HEXOSE, 2,6-DIDEOXY-
Systematic Name English
Code System Code Type Description
CHEBI
30981
Created by admin on Sat Dec 16 09:13:04 GMT 2023 , Edited by admin on Sat Dec 16 09:13:04 GMT 2023
PRIMARY
NSC
87513
Created by admin on Sat Dec 16 09:13:04 GMT 2023 , Edited by admin on Sat Dec 16 09:13:04 GMT 2023
PRIMARY
MERCK INDEX
m4453
Created by admin on Sat Dec 16 09:13:04 GMT 2023 , Edited by admin on Sat Dec 16 09:13:04 GMT 2023
PRIMARY Merck Index
EPA CompTox
DTXSID601031513
Created by admin on Sat Dec 16 09:13:04 GMT 2023 , Edited by admin on Sat Dec 16 09:13:04 GMT 2023
PRIMARY
PUBCHEM
94168
Created by admin on Sat Dec 16 09:13:04 GMT 2023 , Edited by admin on Sat Dec 16 09:13:04 GMT 2023
PRIMARY
CAS
527-52-6
Created by admin on Sat Dec 16 09:13:04 GMT 2023 , Edited by admin on Sat Dec 16 09:13:04 GMT 2023
PRIMARY
FDA UNII
A4R5906C56
Created by admin on Sat Dec 16 09:13:04 GMT 2023 , Edited by admin on Sat Dec 16 09:13:04 GMT 2023
PRIMARY
CAS
49871-87-6
Created by admin on Sat Dec 16 09:13:04 GMT 2023 , Edited by admin on Sat Dec 16 09:13:04 GMT 2023
ALTERNATIVE
ECHA (EC/EINECS)
208-416-6
Created by admin on Sat Dec 16 09:13:04 GMT 2023 , Edited by admin on Sat Dec 16 09:13:04 GMT 2023
PRIMARY