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Details

Stereochemistry ABSOLUTE
Molecular Formula C48H90O13
Molecular Weight 875.2204
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SUCROSE, 1,6'-DISTEARATE

SMILES

CCCCCCCCCCCCCCCCCC(=O)OC[C@H]1O[C@@](COC(=O)CCCCCCCCCCCCCCCCC)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O

InChI

InChIKey=SCWKFJQUEPUEGD-CJKAUBRRSA-N
InChI=1S/C48H90O13/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(50)57-36-39-43(53)46(56)48(60-39,61-47-45(55)44(54)42(52)38(35-49)59-47)37-58-41(51)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h38-39,42-47,49,52-56H,3-37H2,1-2H3/t38-,39-,42-,43-,44+,45-,46+,47-,48+/m1/s1

HIDE SMILES / InChI

Molecular Formula C48H90O13
Molecular Weight 875.2204
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
0X793K0TSL
Record Status Validated (UNII)
Record Version