| Name |
Coriariin A |
| Formula |
C82H58O52 |
| Mw |
1874.18941221 |
| CAS RN |
89871-78-3 |
| C_ID |
C00002914
, 
|
| InChIKey |
BGZMXYWCTRIUII-HYEUTOIMNA-N |
| InChICode |
InChI=1S/C82H58O52/c83-28-1-18(2-29(84)49(28)97)71(112)129-67-65-43(16-122-76(117)23-11-37(92)54(102)59(107)45(23)47-25(78(119)127-65)13-39(94)56(104)61(47)109)125-81(69(67)131-73(114)20-5-32(87)51(99)33(88)6-20)133-75(116)22-9-36(91)53(101)42(10-22)124-64-27(15-41(96)58(106)63(64)111)80(121)134-82-70(132-74(115)21-7-34(89)52(100)35(90)8-21)68(130-72(113)19-3-30(85)50(98)31(86)4-19)66-44(126-82)17-123-77(118)24-12-38(93)55(103)60(108)46(24)48-26(79(120)128-66)14-40(95)57(105)62(48)110/h1-15,43-44,65-70,81-111H,16-17H2/t43-,44-,65+,66+,67-,68-,69+,70+,81-,82-/m0/s1 |
| SMILES |
[C@H]12[C@@H]([C@H]([C@@H](O[C@H]1COC(=O)c1cc(c(c(c1c1c(c(c(cc1C(=O)O2)O)O)O)O)O)O)OC(=O)c1cc(c(c(c1)O)O)Oc1c(c(c(cc1C(=O)O[C@H]1[C@@H]([C@H]([C@H]2[C@@H](O1)COC(=O)c1c(c(c(c(c1)O)O)O)c1c(c(c(cc1C(=O)O2)O)O)O)OC(=O)c1cc(c(c(c1)O)O)O)OC(=O)c1cc(c(c(c1)O)O)O)O)O)O)OC(=O)c1cc(c(c(c1)O)O)O)OC(=O)c1cc(c(c(c1)O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Coriariaceae | Coriaria japonica  | Ref. |
|
|
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