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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H32O16
Molecular Weight 552.4799
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SUCROSE 2,3,3',4',6-PENTAACETATE

SMILES

CC(=O)OC[C@H]1O[C@H](O[C@]2(CO)O[C@H](CO)[C@@H](OC(C)=O)[C@@H]2OC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1O

InChI

InChIKey=AHLIHMGXFJRKSY-ZQNATQRZSA-N
InChI=1S/C22H32O16/c1-9(25)31-7-15-16(30)18(33-11(3)27)19(34-12(4)28)21(36-15)38-22(8-24)20(35-13(5)29)17(32-10(2)26)14(6-23)37-22/h14-21,23-24,30H,6-8H2,1-5H3/t14-,15-,16-,17-,18+,19-,20+,21-,22+/m1/s1

HIDE SMILES / InChI

Molecular Formula C22H32O16
Molecular Weight 552.4799
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:19:30 GMT 2023
Edited
by admin
on Sat Dec 16 10:19:30 GMT 2023
Record UNII
98KX3NW9C5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SUCROSE 2,3,3',4',6-PENTAACETATE
Common Name English
2,3,6,3',4'-PENTAACETYLSUCROSE
Common Name English
6-PAS
Common Name English
.ALPHA.-D-GLUCOPYRANOSIDE, 3,4-DI-O-ACETYL-.BETA.-D-FRUCTOFURANOSYL, 2,3,6-TRIACETATE
Systematic Name English
SUCROSE, 2,3,3',4',6-PENTAACETATE
Common Name English
Code System Code Type Description
PUBCHEM
13828130
Created by admin on Sat Dec 16 10:19:30 GMT 2023 , Edited by admin on Sat Dec 16 10:19:30 GMT 2023
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FDA UNII
98KX3NW9C5
Created by admin on Sat Dec 16 10:19:30 GMT 2023 , Edited by admin on Sat Dec 16 10:19:30 GMT 2023
PRIMARY
CAS
35867-25-5
Created by admin on Sat Dec 16 10:19:30 GMT 2023 , Edited by admin on Sat Dec 16 10:19:30 GMT 2023
PRIMARY
EPA CompTox
DTXSID80957285
Created by admin on Sat Dec 16 10:19:30 GMT 2023 , Edited by admin on Sat Dec 16 10:19:30 GMT 2023
PRIMARY