| Name |
Penicilloside C
(-)-Penicilloside C |
| Formula |
C52H80O21 |
| Mw |
1040.51920962 |
| CAS RN |
366491-77-2 |
| C_ID |
C00037611
, 
|
| InChIKey |
BDKYXBXEOQIKHZ-ZHWJCBLRNA-N |
| InChICode |
InChI=1S/C52H80O21/c1-8-24(2)44(61)67-25(3)30-21-34(72-45(62)27-12-10-9-11-13-27)52(64)50(30,6)18-16-33-49(5)17-15-29(20-28(49)14-19-51(33,52)63)69-48-41(60)43(65-7)42(26(4)68-48)73-47-40(59)38(57)36(55)32(71-47)23-66-46-39(58)37(56)35(54)31(22-53)70-46/h9-13,24-26,28-43,46-48,53-60,63-64H,8,14-23H2,1-7H3/t24-,25-,26+,28-,29-,30+,31+,32+,33+,34+,35+,36+,37-,38-,39+,40+,41+,42-,43+,46+,47-,48-,49-,50+,51-,52+/m0/s1 |
| SMILES |
C1[C@@H](C[C@H]2[C@](C1)([C@@H]1[C@@](CC2)([C@@]2([C@](CC1)([C@H](C[C@H]2OC(=O)c1ccccc1)[C@H](C)OC(=O)[C@H](CC)C)C)O)O)C)O[C@@H]1O[C@@H]([C@@H]([C@@H]([C@H]1O)OC)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)O)O)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Apocynaceae | Caralluma penicillata | Ref. |
|
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