Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C53H80N12O14.C2H4O2 |
| Molecular Weight | 1169.3263 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 11 / 11 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(O)=O.CCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](N)CC(N)=O)[C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC2=CC=C(O)C=C2)C(=O)N[C@H](CO)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N[C@@H](C)C(=O)N[C@H](CO)C(N)=O
InChI
InChIKey=AEWNGTIQHHZLEI-NQFILYFSSA-N
InChI=1S/C53H80N12O14.C2H4O2/c1-7-13-35(58-52(78)41-16-12-21-65(41)53(79)43(29(5)8-2)64-46(72)34(54)25-42(55)69)47(73)59-36(22-28(3)4)49(75)60-38(24-32-17-19-33(68)20-18-32)50(76)63-40(27-67)51(77)61-37(23-31-14-10-9-11-15-31)48(74)57-30(6)45(71)62-39(26-66)44(56)70;1-2(3)4/h9-11,14-15,17-20,28-30,34-41,43,66-68H,7-8,12-13,16,21-27,54H2,1-6H3,(H2,55,69)(H2,56,70)(H,57,74)(H,58,78)(H,59,73)(H,60,75)(H,61,77)(H,62,71)(H,63,76)(H,64,72);1H3,(H,3,4)/t29-,30-,34+,35-,36-,37-,38-,39+,40+,41-,43-;/m0./s1
Approval Year
SUBSTANCE RECORD
![Structure of ALTERNATIVE DEFINITION for [ADP-355 AMIDE ACETATE]](/img/56acf7ab-5933-aa5a-6fe1-86f63646db76.svg "Structure of ALTERNATIVE DEFINITION for [ADP-355 AMIDE ACETATE]")