| Name |
Pterocarinin A |
| Formula |
C46H36O30 |
| Mw |
1068.12913982 |
| CAS RN |
124960-53-8 |
| C_ID |
C00031107
, 
|
| InChIKey |
DYVRUHOWILUBMK-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C46H36O30/c47-6-17(52)30(58)37(65)35(63)24-22-23-21(33(61)38(66)34(22)62)20-11(5-16(51)29(57)32(20)60)45(70)76-41(40(24)75-46(23)71)39-18(73-42(67)8-1-13(48)27(55)14(49)2-8)7-72-43(68)12-3-9(25(53)36(64)26(12)54)19-10(44(69)74-39)4-15(50)28(56)31(19)59/h1-5,17-18,24,30,37,39-41,47-62,64-66H,6-7H2/t17-,18-,24-,30-,37+,39+,40+,41-/m0/s1 |
| SMILES |
C1OC(=O)c2cc(c3c(C(=O)O[C@H]([C@H]1OC(=O)c1cc(c(c(c1)O)O)O)[C@@H]1OC(=O)c4c(c5c6c([C@H]([C@H]1OC6=O)C(=O)[C@@H]([C@@H](O)[C@H](CO)O)O)c(c(c5O)O)O)c(c(c(c4)O)O)O)cc(c(c3O)O)O)c(c(c2O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Rosaceae | Cowania mexicana  | Ref. |
|
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