| Name |
N-Demethylnicaustrine
(+)-N-Demethylnicaustrine |
| Formula |
C42H52N2O11 |
| Mw |
760.35711052 |
| CAS RN |
126617-16-1 |
| C_ID |
C00049494
, 
|
| InChIKey |
MYTZQCJTTCFLHG-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C42H52N2O11/c1-23-31(51-24(2)45)19-29-35(52-25(3)46)37-41(7,17-16-32(42(37)22-50-42)54-33(48)20-30(43-8)27-13-10-9-11-14-27)38(55-39(49)28-15-12-18-44-21-28)36(53-26(4)47)34(23)40(29,5)6/h9-15,18,21,29-32,35-38,43H,16-17,19-20,22H2,1-8H3/t29-,30-,31-,32+,35-,36-,37+,38-,41+,42+/m0/s1 |
| SMILES |
CNC(CC(=O)OC1CCC2(C)C(OC(=O)c3cccnc3)C(OC(C)=O)C3=C(C)C(OC(C)=O)CC(C(OC(C)=O)C2C12CO2)C3(C)C)c1ccccc1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Asp IPP L-His |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Taxaceae | Austrotaxus spicata | Ref. |
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