| Name |
Euphorbin A |
| Formula |
C82H58O53 |
| Mw |
1890.18432683 |
| CAS RN |
180308-72-9 |
| C_ID |
C00040953
, 
|
| InChIKey |
DRDJZBSEZJQQSZ-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C82H58O53/c83-27-1-18(2-28(84)50(27)97)69(109)122-16-43-64(128-70(110)19-3-29(85)51(98)30(86)4-19)67(131-71(111)20-5-31(87)52(99)32(88)6-20)68(80(127-43)134-73(113)22-9-35(91)54(101)36(92)10-22)132-77(117)26-12-38(94)56(103)61(108)62(26)124-41-13-24-46(60(107)58(41)105)45-23(11-37(93)55(102)59(45)106)75(115)130-66-48-78(118)125-40-15-39(95)57(104)65-47(40)49-25(14-44(96)82(121,135-65)81(49,119)120)76(116)129-63(66)42(17-123-74(24)114)126-79(48)133-72(112)21-7-33(89)53(100)34(90)8-21/h1-15,42-43,48-49,63-64,66-68,79-80,83-95,97-108,119-121H,16-17H2/t42-,43-,48+,49-,63-,64+,66+,67+,68-,79+,80+,82-/m0/s1 |
| SMILES |
[C@H]1([C@@H]2[C@@H]3[C@H]([C@H](COC(=O)c4c(c(c(c(Oc5c(C(=O)O[C@@H]6[C@H](O[C@H]([C@H]([C@H]6OC(=O)c6cc(c(c(c6)O)O)O)OC(=O)c6cc(c(c(c6)O)O)O)COC(=O)c6cc(c(c(c6)O)O)O)OC(=O)c6cc(c(c(c6)O)O)O)cc(c(c5O)O)O)c4)O)O)c4c(c(c(cc4C(=O)O3)O)O)O)O1)OC(=O)C1=CC(=O)[C@]3(C([C@@H]1c1c(OC2=O)cc(c(c1O3)O)O)(O)O)O)OC(=O)c1cc(c(c(c1)O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Euphorbiaceae | Acalypha hispida  | Ref. |
|
|
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