| 2-9-Didemnin B, 2-(1-(1,2-dioxopropyl)-L-proline)- |
| Aplidin |
| Aplidine |
| Dehydrodidemnin b |
| Didemnin A, N-(1-(1,2-dioxopropyl)-L-prolyl)- |
| L-Tyrosine, 1-(1,2-dioxopropyl)-L-prolyl-N-methyl-D-leucyl-L-threonyl-(3S,4R,5S)-4-amino-3-hydroxy-5-methylheptanoyl-(2S,4S)-4-hydroxy-2,5-dimethyl-3-oxohexanoyl-L-leucyl-L-prolyl-N,o-dimethyl-, (8-3)-lactone |
| Plitidepsin |
|
Predict NMR spectrum
|
|
| InChI: |
1S/C57H87N7O15/c1-15-33(8)46-44(66)29-45(67)79-49(32(6)7)48(68)34(9)50(69)58-39(26-30(2)3)54(73)64-25-17-19-41(64)56(75)62(13)43(28-37-20-22-38(77-14)23-21-37)57(76)78-36(11)47(52(71)59-46)60-51(70)42(27-31(4)5)61(12)55(74)40-18-16-24-63(40)53(72)35(10)65/h20-23,30-34,36,39-44,46-47,49,66H,15-19,24-29H2,1-14H3,(H,58,69)(H,59,71)(H,60,70)/t33-,34-,36+,39+,40+,41+,42-,43?,44+,46?,47-,49+/m1/s1 |
| InChIKey: |
UUSZLLQJYRSZIS-PKLDCODMSA-N |
|
| H donor: |
4 |
| H acceptor: |
22 |
| Rotatable bond: |
15 |
| Stereocenter: |
12 |
|
| cLogP: |
3.28 |
| cLogS: |
-5.529 |
| Polar surface: |
284.74 |
|