| Name |
1-Dehydroxybaccatin IV
(+)-1-Dehydroxybaccatin IV |
| Formula |
C32H44O13 |
| Mw |
636.27819149 |
| CAS RN |
57672-78-3 |
| C_ID |
C00040783
, 
|
| InChIKey |
GHSKUVKACGPNGN-IABRZNAXNA-N |
| InChICode |
InChI=1S/C32H44O13/c1-14-22(40-15(2)33)11-21-26(42-17(4)35)28-31(10,23(41-16(3)34)12-24-32(28,13-39-24)45-20(7)38)29(44-19(6)37)27(43-18(5)36)25(14)30(21,8)9/h21-24,26-29H,11-13H2,1-10H3/t21-,22-,23-,24+,26+,27+,28-,29-,31+,32-/m0/s1 |
| SMILES |
CC(=O)O[C@H]1[C@@H]2[C@]3(OC(C)=O)CO[C@@H]3C[C@H](OC(C)=O)[C@@]2(C)[C@@H](OC(C)=O)[C@H](OC(C)=O)C2=C(C)[C@@H](OC(C)=O)C[C@@H]1C2(C)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Taxaceae | Taxus baccata  | Ref. |
| Plantae | Taxaceae | Taxus mairei | Ref. |
| Plantae | Taxaceae | Taxus yunnanensis | Ref. |
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