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Details

Stereochemistry ABSOLUTE
Molecular Formula C44H87NO4
Molecular Weight 694.1659
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of N-(2'-(S)-hydroxyhexacosanoyl)-D-erythro-sphingosine

SMILES

CCCCCCCCCCCCCCCCCCCCCCCC[C@H](O)C(=O)N[C@@H](CO)[C@H](O)\C=C\CCCCCCCCCCCCC

InChI

InChIKey=GPDLYLZQDLYUMP-JAMMLTDHSA-N
InChI=1S/C44H87NO4/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-27-29-31-33-35-37-39-43(48)44(49)45-41(40-46)42(47)38-36-34-32-30-28-26-16-14-12-10-8-6-4-2/h36,38,41-43,46-48H,3-35,37,39-40H2,1-2H3,(H,45,49)/b38-36+/t41-,42+,43-/m0/s1

HIDE SMILES / InChI

Molecular Formula C44H87NO4
Molecular Weight 694.1659
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
2TL6JZ3NSM
Record Status Validated (UNII)
Record Version