| Name |
19-Hydroxy-13-oxobaccatin III |
| Formula |
C31H36O12 |
| Mw |
600.22067662 |
| CAS RN |
162613-79-8 |
| C_ID |
C00042058
|
| InChIKey |
ZHZHEIMQSMKZHA-KSGSGGQMSA-N |
| InChICode |
InChI=1S/C31H36O12/c1-15-19(35)12-31(39)26(42-27(38)18-9-7-6-8-10-18)24-29(13-32,20(36)11-21-30(24,14-40-21)43-17(3)34)25(37)23(41-16(2)33)22(15)28(31,4)5/h6-10,20-21,23-24,26,32,36,39H,11-14H2,1-5H3/t20-,21+,23+,24-,26-,29+,30-,31+/m0/s1 |
| SMILES |
O=C([C@@]([C@@H](O)C[C@]1([H])[C@@]2(OC(C)=O)CO1)(CO)[C@]2([H])[C@H](OC(C3=CC=CC=C3)=O)[C@@](C4)(O)C5(C)C)[C@H](OC(C)=O)C5=C(C)C4=O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Taxaceae | Taxus sumatrana  | Ref. |
|
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