| Name |
Celosianin II |
| Formula |
C40H42N2O22 |
| Mw |
902.22292105 |
| CAS RN |
114847-18-6 |
| C_ID |
C00001586
, 
|
| InChIKey |
MPMOZJNSLITZSA-SGJNFYNGNA-N |
| InChICode |
InChI=1S/C40H42N2O22/c1-59-24-10-15(2-4-22(24)44)3-5-27(46)62-33-31(50)30(49)32(38(57)58)63-40(33)64-34-29(48)28(47)26(14-43)61-39(34)60-25-12-17-11-21(37(55)56)42(20(17)13-23(25)45)7-6-16-8-18(35(51)52)41-19(9-16)36(53)54/h2-8,10,12-13,19,21,26,28-34,39-40,43,47-50H,9,11,14H2,1H3,(H6,44,45,46,51,52,53,54,55,56,57,58)/t19-,21-,26+,28+,29-,30-,31-,32-,33+,34+,39+,40-/m0/s1 |
| SMILES |
COc1cc(/C=C/C(=O)OC2[C@H](OC3[C@H](Oc4cc5c(cc4O)/[N+](=C/C=C4/C=C(C(=O)O)N[C@H](C(=O)O)C4)[C@H](C(=O)[O-])C5)OC(CO)[C@@H](O)[C@@H]3O)OC(C(=O)O)[C@@H](O)[C@@H]2O)ccc1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Tyr |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Chenopodiaceae | Chenopodium rubrum | Ref. |
|
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