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

Details

Stereochemistry ABSOLUTE
Molecular Formula C140H262O19
Molecular Weight 2249.5669
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SUCROSE OCTAPALMITATE

SMILES

CCCCCCCCCCCCCCCC(=O)OC[C@H]1O[C@@](COC(=O)CCCCCCCCCCCCCCC)(O[C@H]2O[C@H](COC(=O)CCCCCCCCCCCCCCC)[C@@H](OC(=O)CCCCCCCCCCCCCCC)[C@H](OC(=O)CCCCCCCCCCCCCCC)[C@H]2OC(=O)CCCCCCCCCCCCCCC)[C@@H](OC(=O)CCCCCCCCCCCCCCC)[C@@H]1OC(=O)CCCCCCCCCCCCCCC

InChI

InChIKey=WJPZXFWMBSJTPE-PISRTDAGSA-N
InChI=1S/C140H262O19/c1-9-17-25-33-41-49-57-65-73-81-89-97-105-113-126(141)149-121-124-134(153-129(144)116-108-100-92-84-76-68-60-52-44-36-28-20-12-4)136(155-131(146)118-110-102-94-86-78-70-62-54-46-38-30-22-14-6)137(156-132(147)119-111-103-95-87-79-71-63-55-47-39-31-23-15-7)139(152-124)159-140(123-151-128(143)115-107-99-91-83-75-67-59-51-43-35-27-19-11-3)138(157-133(148)120-112-104-96-88-80-72-64-56-48-40-32-24-16-8)135(154-130(145)117-109-101-93-85-77-69-61-53-45-37-29-21-13-5)125(158-140)122-150-127(142)114-106-98-90-82-74-66-58-50-42-34-26-18-10-2/h124-125,134-139H,9-123H2,1-8H3/t124-,125-,134-,135-,136+,137-,138+,139-,140+/m1/s1

HIDE SMILES / InChI

Molecular Formula C140H262O19
Molecular Weight 2249.5669
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 Fri Dec 15 20:15:36 GMT 2023
Edited
by admin
on Fri Dec 15 20:15:36 GMT 2023
Record UNII
JE1NY6BUOI
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SUCROSE OCTAPALMITATE
Common Name English
NSC-97431
Code English
Code System Code Type Description
CAS
39024-75-4
Created by admin on Fri Dec 15 20:15:36 GMT 2023 , Edited by admin on Fri Dec 15 20:15:36 GMT 2023
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FDA UNII
JE1NY6BUOI
Created by admin on Fri Dec 15 20:15:36 GMT 2023 , Edited by admin on Fri Dec 15 20:15:36 GMT 2023
PRIMARY
PUBCHEM
73543
Created by admin on Fri Dec 15 20:15:36 GMT 2023 , Edited by admin on Fri Dec 15 20:15:36 GMT 2023
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ECHA (EC/EINECS)
254-251-8
Created by admin on Fri Dec 15 20:15:36 GMT 2023 , Edited by admin on Fri Dec 15 20:15:36 GMT 2023
PRIMARY
EPA CompTox
DTXSID501110990
Created by admin on Fri Dec 15 20:15:36 GMT 2023 , Edited by admin on Fri Dec 15 20:15:36 GMT 2023
PRIMARY
NSC
97431
Created by admin on Fri Dec 15 20:15:36 GMT 2023 , Edited by admin on Fri Dec 15 20:15:36 GMT 2023
PRIMARY