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Details

Stereochemistry ABSOLUTE
Molecular Formula C51H77N11O11
Molecular Weight 1020.2242
Optical Activity UNSPECIFIED
Defined Stereocenters 11 / 11
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of ASP-1235 PAF-CONJUGATE

SMILES

CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@H](OC)[C@@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(N)=O)OC)N(C)C(=O)[C@@H](NC(=O)[C@H](C(C)C)N(C)C(=O)CON=C(C)C3=CC=C(C[C@H](N)C(O)=O)C=C3)[C@H](C)N=[N+]=[N-]

InChI

InChIKey=KTADQUNJFALIEA-HGKGIBJTSA-N
InChI=1S/C51H77N11O11/c1-12-30(4)45(40(71-10)27-41(63)62-24-16-19-39(62)46(72-11)31(5)48(66)55-38(47(53)65)26-34-17-14-13-15-18-34)61(9)50(68)43(33(7)57-59-54)56-49(67)44(29(2)3)60(8)42(64)28-73-58-32(6)36-22-20-35(21-23-36)25-37(52)51(69)70/h13-15,17-18,20-23,29-31,33,37-40,43-46H,12,16,19,24-28,52H2,1-11H3,(H2,53,65)(H,55,66)(H,56,67)(H,69,70)/t30-,31+,33?,37-,38-,39-,40+,43-,44-,45-,46+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
ASP-1235 PAF-CONJUGATE
Common Name English
pAF-AGL-0182-30
Preferred Name English
Code System Code Type Description
PUBCHEM
137528211
Created by admin on Wed Apr 02 03:59:12 GMT 2025 , Edited by admin on Wed Apr 02 03:59:12 GMT 2025
PRIMARY
FDA UNII
LV3SEC25GO
Created by admin on Wed Apr 02 03:59:12 GMT 2025 , Edited by admin on Wed Apr 02 03:59:12 GMT 2025
PRIMARY