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

Details

Stereochemistry ABSOLUTE
Molecular Formula C98H191N5O42P4
Molecular Weight 2235.4685
Optical Activity UNSPECIFIED
Defined Stereocenters 28 / 28
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ALANINE-GLYCOSYLPHOSPHATIDYLINOSITOL ANCHOR

SMILES

[H][C@]4(O[C@H]1O[C@H](CO[C@H]2O[C@H](COP(O)(=O)OCCN)[C@@H](O)[C@H](O)[C@]2([H])O[C@H]3O[C@H](COP(O)(=O)OCCNC(=O)[C@H](C)N)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H](O)[C@H](O)[C@@H]1OP(O)(=O)OCCN)[C@H](O)[C@@H](N)[C@@H](O[C@H]5[C@H](O)[C@@H](O)[C@H](O)[C@H](OP(O)(=O)OC[C@@H](COCCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCCC)[C@@H]5OC(=O)CCCCCCCCCCCCCCC)O[C@@H]4CO

InChI

InChIKey=ZKGRMUCBHLXUKY-VPLBXGDDSA-N
InChI=1S/C98H191N5O42P4/c1-5-8-11-14-17-20-23-26-28-30-31-32-33-36-39-41-44-47-50-53-74(105)135-69(63-127-58-52-49-46-43-40-37-34-29-27-24-21-18-15-12-9-6-2)64-132-149(125,126)144-90-86(116)82(112)85(115)89(93(90)140-75(106)54-51-48-45-42-38-35-25-22-19-16-13-10-7-3)142-95-76(102)80(110)88(70(62-104)136-95)141-98-92(145-148(123,124)130-60-56-100)84(114)78(108)71(139-98)65-128-97-91(83(113)79(109)73(138-97)67-133-146(119,120)129-59-55-99)143-96-87(117)81(111)77(107)72(137-96)66-134-147(121,122)131-61-57-103-94(118)68(4)101/h68-73,76-93,95-98,104,107-117H,5-67,99-102H2,1-4H3,(H,103,118)(H,119,120)(H,121,122)(H,123,124)(H,125,126)/t68-,69+,70+,71+,72+,73+,76+,77+,78+,79+,80+,81-,82+,83-,84-,85+,86-,87-,88+,89-,90-,91-,92-,93+,95+,96+,97-,98+/m0/s1

HIDE SMILES / InChI

Molecular Formula C98H191N5O42P4
Molecular Weight 2235.4685
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 28 / 28
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:02:32 GMT 2023
Edited
by admin
on Sat Dec 16 15:02:32 GMT 2023
Record UNII
M2KLN8C9LU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ALANINE-GLYCOSYLPHOSPHATIDYLINOSITOL ANCHOR
Common Name English
GPI-ANCHOR AMIDATED ALANINE
Common Name English
Code System Code Type Description
PUBCHEM
133082186
Created by admin on Sat Dec 16 15:02:32 GMT 2023 , Edited by admin on Sat Dec 16 15:02:32 GMT 2023
PRIMARY
FDA UNII
M2KLN8C9LU
Created by admin on Sat Dec 16 15:02:32 GMT 2023 , Edited by admin on Sat Dec 16 15:02:32 GMT 2023
PRIMARY