Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C39H65N5O8 |
Molecular Weight | 731.9621 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 9 / 9 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@]1(CCCN1C(=O)C[C@@H](OC)[C@H]([C@@H](C)CC)N(C)C(=O)[C@@H](NC(=O)[C@@H](NC)C(C)C)C(C)C)[C@H](OC)[C@@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(O)=O
InChI
InChIKey=MFRNYXJJRJQHNW-DEMKXPNLSA-N
InChI=1S/C39H65N5O8/c1-12-25(6)34(43(9)38(48)33(24(4)5)42-37(47)32(40-8)23(2)3)30(51-10)22-31(45)44-20-16-19-29(44)35(52-11)26(7)36(46)41-28(39(49)50)21-27-17-14-13-15-18-27/h13-15,17-18,23-26,28-30,32-35,40H,12,16,19-22H2,1-11H3,(H,41,46)(H,42,47)(H,49,50)/t25-,26+,28-,29-,30+,32-,33-,34-,35+/m0/s1
Approval Year
Targets
Primary Target | Pharmacology | Condition | Potency |
---|---|---|---|
Target ID: CHEMBL2111464 Sources: https://www.ncbi.nlm.nih.gov/pubmed/27518442 |
60.0 nM [Kd] |
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DTXSID601031563
Created by
admin on Sat Dec 16 11:10:37 GMT 2023 , Edited by admin on Sat Dec 16 11:10:37 GMT 2023
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745017-94-1
Created by
admin on Sat Dec 16 11:10:37 GMT 2023 , Edited by admin on Sat Dec 16 11:10:37 GMT 2023
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10395173
Created by
admin on Sat Dec 16 11:10:37 GMT 2023 , Edited by admin on Sat Dec 16 11:10:37 GMT 2023
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Monomethylauristatin F
Created by
admin on Sat Dec 16 11:10:37 GMT 2023 , Edited by admin on Sat Dec 16 11:10:37 GMT 2023
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1Z1AI9IW5L
Created by
admin on Sat Dec 16 11:10:37 GMT 2023 , Edited by admin on Sat Dec 16 11:10:37 GMT 2023
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PRIMARY |
SUBSTANCE RECORD