Name |
Tabularisin I |
Formula |
C41H50O19 |
Mw |
846.29462942 |
CAS RN |
958220-15-0 |
C_ID |
C00040435
,
|
InChIKey |
WEXXJFHWZFGWBF-UHFFFAOYNA-N |
InChICode |
InChI=1S/C41H50O19/c1-16(2)27(46)56-26-30(49)55-25(20-11-12-52-13-20)36-15-37(26,36)41-32-39(57-28(47)17(3)4)31(54-19(6)43)33(7)14-38(39,50)34(8,22(33)21(29(48)51-10)53-18(5)42)40(41,24(45)23(36)44)59-35(9,58-32)60-41/h11-13,16-17,21-26,31-32,44-45,50H,14-15H2,1-10H3/t21-,22+,23-,24-,25-,26-,31-,32+,33-,34-,35-,36+,37-,38-,39+,40-,41-/m1/s1 |
SMILES |
[C@@]12([C@@]3([C@@]45[C@@]6([C@H]([C@@]1(OC(=O)C(C)C)[C@@H]([C@@]([C@@H]3[C@H](C(=O)OC)OC(=O)C)(C2)C)OC(=O)C)O[C@@](O6)(O5)C)[C@@]12[C@@]([C@@H]([C@H]4O)O)([C@H](OC(=O)[C@H]1OC(=O)C(C)C)c1cocc1)C2)C)O |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Meliaceae | Chukrasia tabularis var. velutina | Ref. |
|
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