| Name |
CAY-1 |
| Formula |
C57H94O29 |
| Mw |
1242.58807705 |
| CAS RN |
318277-23-5 |
| C_ID |
C00048640
, 
|
| InChIKey |
LHFLSIPWAUOODT-ONHNWDMQNA-N |
| InChICode |
InChI=1S/C57H94O29/c1-20-7-10-57(75-19-20)21(2)34-28(86-57)12-25-23-6-5-22-11-27(26(63)13-56(22,4)24(23)8-9-55(25,34)3)76-50-44(73)41(70)46(33(18-62)81-50)82-54-49(85-52-43(72)40(69)36(65)30(15-59)78-52)48(38(67)32(17-61)80-54)84-53-45(74)47(37(66)31(16-60)79-53)83-51-42(71)39(68)35(64)29(14-58)77-51/h20-54,58-74H,5-19H2,1-4H3/t20-,21+,22+,23-,24+,25+,26-,27-,28+,29-,30-,31-,32-,33-,34+,35+,36+,37-,38-,39+,40+,41-,42-,43-,44-,45-,46-,47+,48+,49-,50-,51+,52+,53+,54+,55+,56+,57-/m1/s1 |
| SMILES |
C1[C@H]2[C@H]([C@H]3[C@](C1)([C@@H]1[C@H](C3)O[C@]3([C@H]1C)OC[C@@H](CC3)C)C)CC[C@@H]1[C@@]2(C[C@H]([C@@H](C1)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O[C@H]1[C@@H]([C@@H](O[C@@H]2O[C@@H]([C@@H]([C@@H]([C@H]2O)O)O)CO)[C@@H]([C@H](O1)CO)O)O)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)CO)O)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Solanaceae | Capsicum frutescens  | Ref. |
|
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