Name |
Esculentoside G |
Formula |
C48H74O21 |
Mw |
986.47225943 |
CAS RN |
143381-60-6 |
C_ID |
C00032947
,
|
InChIKey |
DDDHUKSRQZZNCR-CDODBXRPNA-N |
InChICode |
InChI=1S/C48H74O21/c1-43(41(61)63-6)11-13-48(42(62)69-40-36(60)33(57)30(54)25(18-50)66-40)14-12-46(4)21(22(48)15-43)7-8-28-44(2)16-23(52)37(45(3,20-51)27(44)9-10-47(28,46)5)68-38-34(58)31(55)26(19-64-38)67-39-35(59)32(56)29(53)24(17-49)65-39/h7-8,22-27,29-40,49-60H,9-20H2,1-6H3/t22-,23-,24+,25+,26+,27+,29-,30-,31-,32-,33-,34+,35+,36+,37-,38-,39-,40-,43-,44-,45-,46+,47+,48-/m0/s1 |
SMILES |
[C@@H]12[C@@](C3=CC=C4[C@]([C@@]3(CC2)C)(CC[C@@]2([C@H]4C[C@@](CC2)(C)C(=O)OC)C(=O)O[C@@H]2O[C@@H]([C@@H]([C@@H]([C@H]2O)O)O)CO)C)(C[C@@H]([C@@H]([C@@]1(C)CO)O[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)O)C |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Phytolaccaceae | Phytolacca americana | Ref. |
|
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