| Name |
Mirabilin
(+)-Mirabilin |
| Formula |
C58H94O28 |
| Mw |
1238.59316242 |
| CAS RN |
186648-83-9 |
| C_ID |
C00039775
, 
|
| InChIKey |
PJRGLLVWCPCORC-CQWJBNACNA-N |
| InChICode |
InChI=1S/C58H94O28/c1-53(2)30-9-12-56(5)31(8-7-23-24-15-54(3,52(75)76)13-14-58(24,22-61)32(63)16-57(23,56)6)55(30,4)11-10-33(53)84-50-45(86-49-44(74)40(70)36(66)27(18-60)81-49)38(68)29(21-79-50)83-51-46(85-48-42(72)34(64)25(62)19-77-48)41(71)37(67)28(82-51)20-78-47-43(73)39(69)35(65)26(17-59)80-47/h7,24-51,59-74H,8-22H2,1-6H3,(H,75,76)/t24-,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-,54-,55-,56+,57+,58+/m0/s1 |
| SMILES |
[C@@]1(CC[C@]2([C@@H](C1)C1=CC[C@H]3[C@]([C@@]1(C[C@H]2O)C)(CC[C@@H]1[C@@]3(CC[C@@H](C1(C)C)O[C@@H]1OC[C@@H]([C@@H]([C@H]1O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)O)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@@H]1OC[C@H]([C@@H]([C@H]1O)O)O)C)C)CO)(C)C(=O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Myrsinaceae | Cyclamen mirabile | Ref. |
| - | - | Siliquariaspongia mirabilis | Ref. |
|
|
zoom in
| Organism | Siliquariaspongia mirabilis |
|---|
| Reference | Plaza,J.Nat.Prod.,71,(2008),473 |
|---|
|
