| Name |
Kinmoonoside C
(+)-Kinmoonoside C |
| Formula |
C80H128O40 |
| Mw |
1728.79818898 |
| CAS RN |
316146-88-0 |
| C_ID |
C00046790
, 
|
| InChIKey |
VMHSOXVWGGXLLL-KJNDORSINA-N |
| InChICode |
InChI=1S/C80H128O40/c1-11-76(7,105)18-12-13-32(24-81)65(103)114-45-23-80(73(104)120-72-64(54(96)49(91)38(27-84)112-72)119-70-60(102)62(117-68-58(100)52(94)47(89)36(25-82)109-68)61(31(2)108-70)116-67-57(99)50(92)39(28-85)111-67)34(21-74(45,3)4)33-14-15-42-77(8)19-17-44(75(5,6)41(77)16-20-78(42,9)79(33,10)22-43(80)87)115-71-63(118-69-59(101)53(95)48(90)37(26-83)110-69)55(97)51(93)40(113-71)30-107-66-56(98)46(88)35(86)29-106-66/h11,13-14,31,34-64,66-72,81-102,105H,1,12,15-30H2,2-10H3/b32-13+/t31-,34-,35-,36+,37+,38+,39-,40+,41-,42+,43+,44-,45-,46-,47+,48+,49+,50-,51+,52-,53-,54-,55-,56+,57+,58+,59+,60+,61-,62-,63+,64+,66-,67-,68-,69-,70-,71-,72-,76-,77-,78+,79+,80+/m0/s1 |
| SMILES |
C=CC(C)(O)CC/C=C(CO)C(=O)O[C@H]1C[C@]2(C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3O[C@@H](C)[C@H](O[C@@H]4O[C@@H](CO)[C@H](O)[C@H]4O)[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H]3O)[C@H](O)C[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO[C@@H]7OC[C@H](O)[C@H](O)[C@H]7O)[C@@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2CC1(C)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Fabaceae | Acacia concinna  | Ref. |
|
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