| Name |
Halicylindroside A1 |
| Formula |
C48H94N2O9 |
| Mw |
842.69593261 |
| CAS RN |
161842-86-0 |
| C_ID |
C00028318
, 
|
| InChIKey |
MHWAOEOFBPPBNO-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C48H94N2O9/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-26-29-32-35-43(54)50-40(37-58-48-44(49-39(4)52)47(57)46(56)42(36-51)59-48)45(55)41(53)34-31-28-25-22-20-21-24-27-30-33-38(2)3/h38,40-42,44-48,51,53,55-57H,5-37H2,1-4H3,(H,49,52)(H,50,54)/t40-,41+,42-,44-,45-,46-,47+,48-/m0/s1 |
| SMILES |
[C@H]1([C@H]([C@H]([C@H]([C@@H](O1)CO)O)O)NC(=O)C)OC[C@H](NC(=O)CCCCCCCCCCCCCCCCCCCCC)[C@@H]([C@H](O)CCCCCCCCCCCC(C)C)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Pro L-Lys L-Arg L-Ala |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Animalia | Halichondriidae | Halichondria cylindrata | Ref. |
|
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