| Name |
Rubusuavin C |
| Formula |
C82H54O52 |
| Mw |
1870.15811208 |
| CAS RN |
145851-28-1 |
| C_ID |
C00057071
|
| InChIKey |
FFZOOOCGCNFHAQ-UHFFFAOYSA-N |
| InChICode |
InChI=1S/C82H54O52/c83-23-1-14(2-24(84)45(23)93)71(112)133-81-70-68(130-77(118)20-9-30(90)50(98)57(105)39(20)41-22(79(120)132-70)11-32(92)52(100)59(41)107)65-35(126-81)13-123-74(115)17-6-27(87)53(101)60(108)42(17)43-44(80(121)128-65)66(63(111)62(110)61(43)109)124-33-4-15(3-25(85)46(33)94)72(113)134-82-69-67(129-76(117)19-8-29(89)49(97)56(104)38(19)40-21(78(119)131-69)10-31(91)51(99)58(40)106)64-34(125-82)12-122-73(114)16-5-26(86)47(95)54(102)36(16)37-18(75(116)127-64)7-28(88)48(96)55(37)103/h1-11,34-35,64-65,67-70,81-111H,12-13H2 |
| SMILES |
O=C(OC1OC2COC(=O)c3cc(O)c(O)c(O)c3-c3c(cc(O)c(O)c3O)C(=O)OC2C2OC(=O)c3cc(O)c(O)c(O)c3-c3c(cc(O)c(O)c3O)C(=O)OC12)c1cc(O)c(O)c(Oc2c(O)c(O)c(O)c3c2C(=O)OC2C(COC(=O)c4cc(O)c(O)c(O)c4-3)OC(OC(=O)c3cc(O)c(O)c(O)c3)C3OC(=O)c4cc(O)c(O)c(O)c4-c4c(cc(O)c(O)c4O)C(=O)OC23)c1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Rosaceae | Rubus glaucus | Ref. |
| Plantae | Rosaceae | Rubus suavissimus  | Ref. |
|
|
zoom in
| Organism | Rubus glaucus |
|---|
| Reference | Li, H. et al., Chem. Pharm. Bull., 2007, 55, 1325-1331 (Rubusuavin C) |
|---|
|
