Name |
Corymbivillosol acetate |
Formula |
C45H70O7 |
Mw |
722.51215459 |
CAS RN |
113476-74-7 |
C_ID |
C00022213
,
|
InChIKey |
SUSJWMBKQDLIRU-FTIAGVEQNA-N |
InChICode |
InChI=1S/C45H70O7/c1-29(22-26-46)12-16-34-31(3)15-19-37-43(8,9)39(21-25-45(34,37)11)52-41(49)28-40(48)50-27-23-30(2)13-17-35-32(4)14-18-36-42(6,7)38(51-33(5)47)20-24-44(35,36)10/h14-15,22-23,34-39,46H,12-13,16-21,24-28H2,1-11H3/b29-22+,30-23+/t34-,35-,36-,37-,38+,39+,44-,45-/m1/s1 |
SMILES |
C1=C([C@H]([C@@]2([C@H](C1)C([C@H](CC2)OC(=O)CC(=O)OC/C=C(/CC[C@H]1[C@@]2([C@H](CC=C1C)C([C@H](CC2)OC(=O)C)(C)C)C)\C)(C)C)C)CC/C(=C/CO)/C)C |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Asteraceae | Corymbium villosum | Ref. |
|
|
zoom in
|