| Name |
Tyrianthin 4
(-)-Tyrianthin 4 |
| Formula |
C54H90O23 |
| Mw |
1106.58728918 |
| CAS RN |
930106-39-1 |
| C_ID |
C00040592
, 
|
| InChIKey |
LHLFKXPQOIJCPM-YXMGQOAGNA-N |
| InChICode |
InChI=1S/C54H90O23/c1-10-13-19-23-33-24-20-17-15-14-16-18-21-25-36(57)72-47-44(75-51-42(63)41(62)43(31(8)68-51)74-49(64)27(4)12-3)32(9)69-54(48(47)73-35(56)22-11-2)77-46-40(61)38(59)34(26-66-50(65)28(5)29(6)55)71-53(46)76-45-39(60)37(58)30(7)67-52(45)70-33/h12,28-34,37-48,51-55,58-63H,10-11,13-26H2,1-9H3/b27-12+/t28-,29+,30-,31-,32+,33+,34-,37-,38-,39+,40+,41-,42-,43-,44+,45-,46-,47-,48+,51+,52+,53+,54+/m1/s1 |
| SMILES |
[C@@H]1(O[C@@H]2[C@@H]([C@H]([C@@H]1O)O)O[C@H]1[C@H]([C@H](OC(=O)CCCCCCCCC[C@@H](O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C)O)O)O2)CCCCC)[C@H]([C@@H](O1)C)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)OC(=O)/C(=C/C)/C)C)OC(=O)CCC)COC(=O)[C@@H]([C@H](C)O)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Convolvulaceae | Ipomoea tyrianthina | Ref. |
|
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