Name |
Potentillanin |
Formula |
C42H46O22 |
Mw |
902.24807316 |
CAS RN |
118555-81-0 |
C_ID |
C00008913
,
|
InChIKey |
VXDLCNYCLBNAQX-PKDIAKMFNA-N |
InChICode |
InChI=1S/C42H46O22/c43-11-29-32(53)34(55)36(57)41(62-29)60-27-9-18-21(48)10-25(52)31(40(18)64-38(27)13-1-2-19(46)22(49)3-13)15-6-23(50)24(51)7-16(15)39-28(8-17-20(47)4-14(45)5-26(17)59-39)61-42-37(58)35(56)33(54)30(12-44)63-42/h1-7,10,27-30,32-39,41-58H,8-9,11-12H2/t27-,28+,29-,30+,32+,33+,34-,35-,36+,37-,38+,39+,41+,42-/m0/s1 |
SMILES |
c1(cc(c2c(c1c1cc(c(cc1[C@@H]1[C@@H](Cc3c(O1)cc(cc3O)O)O[C@@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)O)O[C@@H]([C@H](C2)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O)c1ccc(c(c1)O)O)O)O |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Rosaceae | Potentilla viscosa | Ref. |
|
|
zoom in
|