Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C53H86N12O11 |
| Molecular Weight | 1067.3237 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 8 / 8 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)C(C)(C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N[C@@H](CC2=CNC3=C2C=CC=C3)C(=O)N[C@@H](C(C)C)C(O)=O
InChI
InChIKey=NKVJPKWKIISAAJ-POSKKVNKSA-N
InChI=1S/C53H86N12O11/c1-28(2)24-37(46(69)61-39(47(70)63-43(31(7)8)51(74)75)26-32-27-57-35-18-12-11-16-33(32)35)60-45(68)36(20-21-41(56)66)58-50(73)42(30(5)6)62-49(72)40-19-15-23-65(40)52(76)53(9,10)64-48(71)38(25-29(3)4)59-44(67)34(55)17-13-14-22-54/h11-12,16,18,27-31,34,36-40,42-43,57H,13-15,17,19-26,54-55H2,1-10H3,(H2,56,66)(H,58,73)(H,59,67)(H,60,68)(H,61,69)(H,62,72)(H,63,70)(H,64,71)(H,74,75)/t34-,36-,37-,38-,39-,40-,42-,43-/m0/s1
![Structure of ALTERNATIVE DEFINITION for [EP-2101 COMPONENT LYS-LEU-AIB-PRO-VAL-GLN-LEU-TRP-VAL]](/img/1289302f-fee3-4dd0-ca24-b652aaf0dbc2.svg "Structure of ALTERNATIVE DEFINITION for [EP-2101 COMPONENT LYS-LEU-AIB-PRO-VAL-GLN-LEU-TRP-VAL]")