| Name |
Alatanin A |
| Formula |
C67H81O39 |
| Mw |
1509.43549785 |
| CAS RN |
139610-21-2 |
| C_ID |
C00055482
|
| InChIKey |
HWNDTEYNINVJQQ-UHFFFAOYSA-O |
| InChICode |
InChI=1S/C67H80O39/c1-90-33-11-24(12-34(91-2)45(33)74)5-9-43(72)94-21-40-49(78)54(83)56(85)64(104-40)97-27-16-30(71)28-18-37(61(98-31(28)17-27)26-7-8-29(70)32(15-26)99-65-57(86)52(81)47(76)38(19-68)101-65)100-66-58(87)55(84)50(79)41(105-66)23-96-63-60(89)62(106-67-59(88)53(82)48(77)39(20-69)102-67)51(80)42(103-63)22-95-44(73)10-6-25-13-35(92-3)46(75)36(14-25)93-4/h5-18,38-42,47-60,62-69,76-89H,19-23H2,1-4H3,(H3-,70,71,72,73,74,75)/p+1 |
| SMILES |
COc1cc(/C=C/C(=O)OCC2OC(Oc3cc(O)c4cc(OC5OC(COC6OC(COC(=O)/C=C/c7cc(OC)c(O)c(OC)c7)C(O)C(OC7OC(CO)C(O)C(O)C7O)C6O)C(O)C(O)C5O)c(-c5ccc(O)c(OC6OC(CO)C(O)C(O)C6O)c5)[o+]c4c3)C(O)C(O)C2O)cc(OC)c1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Dioscoreaceae | Dioscorea alata  | Ref. |
|
|
zoom in
| Organism | Dioscorea alata |
|---|
| Reference | Willstatter, R. et al., Annalen, 1913, 401, 189-232 (isol) |
|---|
|
