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Details

Stereochemistry EPIMERIC
Molecular Formula C66H117NO5
Molecular Weight 1004.6389
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 11
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of STIGMASTERYL-.GAMMA.-OCTYLDODECYL LAUROYL GLUTAMATE

SMILES

[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)OC(=O)[C@H](CCC(=O)OCC(CCCCCCCC)CCCCCCCCCC)NC(=O)CCCCCCCCCCC)[C@H](C)\C=C\[C@@H](CC)C(C)C

InChI

InChIKey=NDWMBRZVESZFOT-QHIJYGAOSA-N
InChI=1S/C66H117NO5/c1-10-14-17-20-23-25-27-30-33-36-62(68)67-61(43-44-63(69)71-50-53(34-31-28-22-19-16-12-3)35-32-29-26-24-21-18-15-11-2)64(70)72-56-45-47-65(8)55(49-56)39-40-57-59-42-41-58(66(59,9)48-46-60(57)65)52(7)37-38-54(13-4)51(5)6/h37-39,51-54,56-61H,10-36,40-50H2,1-9H3,(H,67,68)/b38-37+/t52-,53?,54-,56+,57+,58-,59+,60+,61+,65+,66-/m1/s1

HIDE SMILES / InChI

Molecular Formula C66H117NO5
Molecular Weight 1004.6389
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 10 / 11
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:36:14 GMT 2023
Edited
by admin
on Sat Dec 16 10:36:14 GMT 2023
Record UNII
8PGW0Z5LIG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
STIGMASTERYL-.GAMMA.-OCTYLDODECYL LAUROYL GLUTAMATE
Common Name English
L-GLUTAMIC ACID, N-(1-OXODODECYL)-, 1-(3.BETA.,22E)-STIGMASTA-5,22-DIEN-3-YL 5-DOCOSYL ESTER
Systematic Name English
Code System Code Type Description
PUBCHEM
139032964
Created by admin on Sat Dec 16 10:36:14 GMT 2023 , Edited by admin on Sat Dec 16 10:36:14 GMT 2023
PRIMARY
FDA UNII
8PGW0Z5LIG
Created by admin on Sat Dec 16 10:36:14 GMT 2023 , Edited by admin on Sat Dec 16 10:36:14 GMT 2023
PRIMARY