Name |
Cyananin |
Formula |
C42H47O22 |
Mw |
903.25589819 |
CAS RN |
135558-27-9 |
C_ID |
C00006855
, 
|
InChIKey |
XSOXQXPLSCSJPY-UHFFFAOYNA-O |
InChICode |
InChI=1S/C42H46O22/c1-16-38(64-29(48)9-4-17-2-6-19(44)7-3-17)34(53)37(56)40(58-16)57-15-28-31(50)33(52)36(55)42(63-28)61-26-13-21-24(59-39(26)18-5-8-22(46)23(47)10-18)11-20(45)12-25(21)60-41-35(54)32(51)30(49)27(14-43)62-41/h2-13,16,27-28,30-38,40-43,49-56H,14-15H2,1H3,(H3-,44,45,46,47,48)/p+1/t16-,27+,28-,30+,31+,32-,33+,34+,35-,36-,37+,38-,40+,41+,42+/m0/s1 |
SMILES |
c1(cc(c2c(c1)[o+]c(c(c2)O[C@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)CO[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)C)OC(=O)/C=C/c1ccc(cc1)O)O)O)O)O)O)c1ccc(c(c1)O)O)O[C@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Solanaceae | Petunia x hybrida | Ref. |
Plantae | Solanaceae | Solanum phureja | Ref. |
Plantae | Solanaceae | Solanum tuberosum  | Ref. |
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