| Name |
Sudachiin D |
| Formula |
C54H58O29 |
| Mw |
1170.3063759 |
| CAS RN |
101339-36-0 |
| C_ID |
C00004448
, 
|
| InChIKey |
MOGDUWJQHVRLBE-GYTVXUKGNA-N |
| InChICode |
InChI=1S/C54H58O29/c1-54(69,16-32(58)76-18-30-36(60)40(64)42(66)52(81-30)80-25-11-9-21(13-29(25)71-3)27-14-23(56)34-38(62)47(72-4)44(68)49(74-6)45(34)78-27)17-33(59)77-19-31-37(61)41(65)43(67)53(82-31)83-51-48(73-5)39(63)35-24(57)15-26(79-46(35)50(51)75-7)20-8-10-22(55)28(12-20)70-2/h8-15,30-31,36-37,40-43,52-53,55,60-69H,16-19H2,1-7H3/t30-,31+,36+,37+,40-,41-,42-,43+,52+,53-,54+/m0/s1 |
| SMILES |
COc1cc(-c2cc(=O)c3c(O)c(OC)c(O[C@@H]4OC(COC(=O)CC(C)(O)CC(=O)OC[C@@H]5O[C@@H](Oc6ccc(-c7cc(=O)c8c(O)c(OC)c(O)c(OC)c8o7)cc6OC)C(O)C(O)[C@@H]5O)[C@@H](O)[C@H](O)C4O)c(OC)c3o2)ccc1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Rutaceae | Citrus sudachi  | Ref. |
|
|
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