| Name |
Taxol D |
| Formula |
C44H53NO14 |
| Mw |
819.34660541 |
| CAS RN |
153415-46-4 |
| C_ID |
C00041170
, 
|
| InChIKey |
SXPIMOCRRJUHJY-CHOCICHSNA-N |
| InChICode |
InChI=1S/C44H53NO14/c1-8-15-31(49)45-33(26-16-11-9-12-17-26)34(50)40(53)57-28-21-44(54)38(58-39(52)27-18-13-10-14-19-27)36-42(7,29(48)20-30-43(36,22-55-30)59-25(4)47)37(51)35(56-24(3)46)32(23(28)2)41(44,5)6/h9-14,16-19,28-30,33-36,38,48,50,54H,8,15,20-22H2,1-7H3,(H,45,49)/t28-,29-,30+,33-,34+,35+,36-,38-,42+,43-,44+/m0/s1 |
| SMILES |
CCCC(=O)N[C@@H](c1ccccc1)[C@@H](O)C(=O)O[C@H]1C[C@@]2(O)[C@@H](OC(=O)c3ccccc3)[C@@H]3[C@]4(OC(C)=O)CO[C@@H]4C[C@H](O)[C@@]3(C)C(=O)[C@H](OC(C)=O)C(=C1C)C2(C)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Asp L-His |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Taxaceae | Taxus baccata  | Ref. |
| Plantae | Taxaceae | Taxus cuspidata | Ref. |
| Plantae | Taxaceae | Taxus media | Ref. |
| Plantae | Taxaceae | Taxus x media | Ref. |
|
|
zoom in
| Organism | Taxus baccata |
|---|
| Reference | Balogle, et al., JNP, 62, (1999), 1448.
Ma, et al., JNP, 57, (1994), 116.
Kobayashi, et al., Tetrahedron, 51, (1995), 5971 |
|---|
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