| Name |
Mycaloside K
(-)-Mycaloside K |
| Formula |
C53H86O24 |
| Mw |
1106.55090368 |
| CAS RN |
1100360-24-4 |
| C_ID |
C00048782
, 
|
| InChIKey |
XVNMNJMQUFORCD-OKFDGADRNA-N |
| InChICode |
InChI=1S/C53H86O24/c1-21(2)22(3)7-8-24(16-54)28-15-29(58)35-25-9-10-27-36(60)31(12-14-52(27,5)26(25)11-13-53(28,35)6)71-50-44(68)46(45(34(74-50)20-69-23(4)57)75-48-42(66)40(64)38(62)32(17-55)72-48)76-51-47(37(61)30(59)19-70-51)77-49-43(67)41(65)39(63)33(18-56)73-49/h7-8,10,21-22,24-26,28-51,54-56,58-68H,9,11-20H2,1-6H3/b8-7+/t22-,24+,25+,26-,28+,29-,30+,31-,32+,33+,34+,35+,36+,37+,38-,39-,40-,41-,42+,43+,44+,45+,46+,47-,48-,49+,50+,51-,52+,53+/m0/s1 |
| SMILES |
CC(=O)OC[C@H]1O[C@@H](O[C@H]2CC[C@@]3(C)C(=CC[C@H]4[C@@H]5[C@@H](O)C[C@H]([C@@H](/C=C/[C@H](C)C(C)C)CO)[C@@]5(C)CC[C@@H]43)[C@H]2O)[C@H](O)[C@@H](O[C@@H]2OC[C@@H](O)[C@@H](O)[C@@H]2O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H]1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Animalia | Agelasidae | Agelas sp. | Ref. |
| - | - | Mycale laxissima | Ref. |
|
|
zoom in
| Organism | Mycale laxissima |
|---|
| Reference | Blunt,Nat.Prod.Rep.,27,(2010),165 |
|---|
|
