| Name |
Toddacoumalone |
| Formula |
C31H31NO6 |
| Mw |
513.21513773 |
| CAS RN |
139750-79-1 |
| C_ID |
C00000513
, 
|
| InChIKey |
IOVBMEHJQSKXAU-MPUSNXLWNA-N |
| InChICode |
InChI=1S/C31H31NO6/c1-18(2)15-19-17-31(3,38-29-20-9-7-8-10-23(20)32(4)30(34)27(19)29)14-13-22-25(36-6)16-24(35-5)21-11-12-26(33)37-28(21)22/h7-16,19H,17H2,1-6H3/b14-13+/t19-,31+/m1/s1 |
| SMILES |
COc1cc(OC)c2ccc(=O)oc2c1/C=C/[C@@]1(C)C[C@@H](C=C(C)C)c2c(c3ccccc3n(C)c2=O)O1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
Anthranilate |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Rutaceae | Toddalia asiatica  | Ref. |
|
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