| Name |
2'-N-(1''-deoxy-1''-beta-D-fructopyranosyl)neocephaeline |
| Formula |
C34H48N2O9 |
| Mw |
628.33598115 |
| CAS RN |
261515-33-7 |
| C_ID |
C00038231
, 
|
| InChIKey |
NATGFJZOCKZGKQ-IEVVZILONA-N |
| InChICode |
InChI=1S/C34H48N2O9/c1-5-19-16-35-10-9-21-14-28(43-3)29(44-4)15-23(21)24(35)12-22(19)13-25-30-20(6-7-27(42-2)32(30)39)8-11-36(25)18-34(41)33(40)31(38)26(37)17-45-34/h6-7,14-15,19,22,24-26,31,33,37-41H,5,8-13,16-18H2,1-4H3/t19-,22+,24-,25+,26+,31+,33-,34+/m0/s1 |
| SMILES |
CC[C@H]1CN2CCc3cc(OC)c(OC)cc3[C@@H]2C[C@@H]1C[C@@H]1c2c(ccc(OC)c2O)CCN1C[C@@]1(O)OC[C@@H](O)[C@@H](O)[C@@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Tyr Secologanin |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Rubiaceae | Cephaelis acuminata | Ref. |
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