Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C64H99N17O16S |
| Molecular Weight | 1394.6438 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 13 / 13 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC[C@H](C)[C@H](NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CSC(=N1)[C@@H](N)C(C)C)C(=O)N[C@H]2CCCCNC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](CC(O)=O)NC(=O)[C@H](CC3=CN=CN3)NC(=O)[C@@H](CC4=CC=CC=C4)NC(=O)[C@@H](NC(=O)[C@@H](CCCN)NC2=O)C(C)C
InChI
InChIKey=CHLOWYWCJJLLHA-NXISNYNLSA-N
InChI=1S/C64H99N17O16S/c1-9-35(8)52(81-56(90)40(20-21-48(83)84)72-57(91)41(24-32(2)3)74-61(95)46-30-98-64(79-46)50(67)33(4)5)63(97)73-38-18-13-14-23-69-53(87)44(27-47(66)82)76-60(94)45(28-49(85)86)77-59(93)43(26-37-29-68-31-70-37)75-58(92)42(25-36-16-11-10-12-17-36)78-62(96)51(34(6)7)80-55(89)39(19-15-22-65)71-54(38)88/h10-12,16-17,29,31-35,38-46,50-52H,9,13-15,18-28,30,65,67H2,1-8H3,(H2,66,82)(H,68,70)(H,69,87)(H,71,88)(H,72,91)(H,73,97)(H,74,95)(H,75,92)(H,76,94)(H,77,93)(H,78,96)(H,80,89)(H,81,90)(H,83,84)(H,85,86)/t35-,38-,39+,40+,41-,42+,43-,44-,45+,46-,50-,51-,52-/m0/s1
Approval Year
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149146-34-9
Created by
admin on Wed Apr 02 13:23:11 GMT 2025 , Edited by admin on Wed Apr 02 13:23:11 GMT 2025
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2Z7FA2NR3G
Created by
admin on Wed Apr 02 13:23:11 GMT 2025 , Edited by admin on Wed Apr 02 13:23:11 GMT 2025
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PRIMARY |
![Structure of 4,10-anhydro[N-[[(4R)-2-[(1S)-1-amino-2-methylpropyl]-4,5-dihydro-1,3-thiazol-4-yl]carbonyl]-L-leucyl-D-?-glutamyl-L-isoleucyl-L-lysyl-D-ornithyl-L-valyl-D-phenylalanyl-L-histidyl-D-?-aspartyl-L-asparagine]](/img/b3296c0a-7739-497d-9220-b5f437e5c32b.svg "Structure of 4,10-anhydro[N-[[(4R)-2-[(1S)-1-amino-2-methylpropyl]-4,5-dihydro-1,3-thiazol-4-yl]carbonyl]-L-leucyl-D-?-glutamyl-L-isoleucyl-L-lysyl-D-ornithyl-L-valyl-D-phenylalanyl-L-histidyl-D-?-aspartyl-L-asparagine]")