| Name |
Sandrapin B |
| Formula |
C36H46O14 |
| Mw |
702.28875618 |
| CAS RN |
652156-90-6 |
| C_ID |
C00057486
|
| InChIKey |
OPNCNLNPCUFGKK-OFENYXJYSA-N |
| InChICode |
InChI=1S/C36H46O14/c1-11-16(2)31(42)48-24-28(46-18(4)37)33(6,7)21(14-22(39)44-10)34(8)25(40)23-17(3)36(50-29(24)34)30(47-19(5)38)32(43)49-27(20-12-13-45-15-20)35(36,9)26(23)41/h12-13,15-16,21,23-24,26-30,41H,3,11,14H2,1-2,4-10H3/t16?,21-,23-,24-,26-,27-,28-,29-,30+,34-,35-,36+/m0/s1 |
| SMILES |
O=C1O[C@@H](C2=COC=C2)[C@]3(C)[C@@H](O)[C@@]([H])(C4=C)C([C@@]5(C)[C@@]([C@@H](OC(C(CC)C)=O)[C@H](OC(C)=O)C(C)(C)[C@@H]5CC(OC)=O)([H])O[C@]34[C@@H]1OC(C)=O)=O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Meliaceae | Sandoricum koetjape  | Ref. |
|
|
zoom in
| Organism | Sandoricum koetjape |
|---|
| Reference | Ismail, I.S. et al., Phytochemistry, 2003, 64, 1345-1349 (isol, pmr, cmr) |
|---|
|
