| Name |
Emarginatine C |
| Formula |
C41H48N2O18 |
| Mw |
856.29021275 |
| CAS RN |
156280-96-5 |
| C_ID |
C00028240
, 
|
| InChIKey |
OOZYNQOOJZTXAC-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C41H48N2O18/c1-18-19(2)35(50)60-33-30(59-36(51)24-12-13-26(48)43(9)15-24)34(58-23(6)47)40(17-54-20(3)44)31(49)29(56-21(4)45)27-32(57-22(5)46)41(40,39(33,8)53)61-38(27,7)16-55-37(52)25-11-10-14-42-28(18)25/h10-15,18-19,27,29-34,49,53H,16-17H2,1-9H3/t18-,19+,27-,29-,30+,31+,32-,33-,34+,38+,39+,40-,41+/m0/s1 |
| SMILES |
CC(=O)OCC12C(O)C(OC(C)=O)C3C(OC(C)=O)C14OC3(C)COC(=O)c1cccnc1C(C)C(C)C(=O)OC(C(OC(=O)c1ccc(=O)n(C)c1)C2OC(C)=O)C4(C)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Asp L-His |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Celastraceae | Maytenus emarginata | Ref. |
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