| Name |
Mycaloside C
(-)-Mycaloside C |
| Formula |
C50H82O23 |
| Mw |
1050.52468893 |
| CAS RN |
593280-52-5 |
| C_ID |
C00044942
, 
|
| InChIKey |
OZHQPYQAYSNYDS-UBLNBLQQNA-N |
| InChICode |
InChI=1S/C50H82O23/c1-20(2)6-5-7-21(15-51)25-14-26(55)32-22-8-9-24-33(57)28(11-13-49(24,3)23(22)10-12-50(25,32)4)67-48-41(65)44(43(31(18-54)70-48)72-47-39(63)37(61)35(59)30(17-53)69-47)73-45-40(64)42(27(56)19-66-45)71-46-38(62)36(60)34(58)29(16-52)68-46/h5,7,9,20-23,25-48,51-65H,6,8,10-19H2,1-4H3/b7-5+/t21-,22-,23+,25-,26+,27-,28+,29-,30-,31-,32-,33-,34+,35+,36+,37+,38-,39-,40+,41-,42-,43-,44-,45+,46+,47+,48-,49-,50-/m1/s1 |
| SMILES |
O1C[C@H]([C@H]([C@@H]([C@@H]1O[C@H]1[C@H](O[C@@H]2O[C@@H]([C@@H]([C@@H]([C@H]2O)O)O)CO)[C@H](O[C@H]([C@@H]1O)O[C@H]1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]2([C@H]3[C@H](C[C@@H]2[C@@H](CO)/C=C/CC(C)C)O)C)[C@H]1O)C)CO)O)O[C@@H]1O[C@@H]([C@@H]([C@@H]([C@H]1O)O)O)CO)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| - | - | Mycale laxissima | Ref. |
|
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