| Name |
Trigonotin A
(+)-Trigonotin A |
| Formula |
C35H40O19 |
| Mw |
764.2163791 |
| CAS RN |
1036375-78-6 |
| C_ID |
C00040561
, 
|
| InChIKey |
PKBCQPPURBFDJW-QGECHGSJNA-N |
| InChICode |
InChI=1S/C35H40O19/c1-13(37)49-10-20-25(39)28(42)29(43)34(51-20)54-35(12-36)31-27(41)21(53-35)11-50-32(44)16-7-15-9-19(47-3)26(40)30(48-4)23(15)22(24(16)33(45)52-31)14-5-6-17(38)18(8-14)46-2/h5-9,20-22,24-25,27-29,31,34,36,38-43H,10-12H2,1-4H3/t20-,21-,22-,24+,25-,27-,28+,29-,31+,34-,35-/m1/s1 |
| SMILES |
COc1cc([C@@H]2c3c(cc(OC)c(O)c3OC)C=C3C(=O)OC[C@H]4OC(CO)(O[C@H]5O[C@H](COC(C)=O)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](OC(=O)[C@@H]32)[C@@H]4O)ccc1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Boraginaceae | Trigonotis peduncularis | Ref. |
|
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