| Name |
Gemmacolide B
(-)-Gemmacolide B |
| Formula |
C33H45ClO14 |
| Mw |
700.24978386 |
| CAS RN |
134887-85-7 |
| C_ID |
C00031808
, 
|
| InChIKey |
OJVGXQLUNKMDNO-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C33H45ClO14/c1-10-14(2)29(39)47-23-26(44-18(6)36)31(9)21(43-17(5)35)12-11-15(3)22(34)25-33(41,16(4)30(40)48-25)28(46-20(8)38)24(31)32(13-42-32)27(23)45-19(7)37/h14,16,21-28,41H,3,10-13H2,1-2,4-9H3/t14-,16+,21+,22-,23+,24+,25+,26+,27-,28+,31+,32+,33+/m0/s1 |
| SMILES |
[C@@H]1([C@@H]([C@]2([C@H]3[C@]([C@@H]1OC(=O)C)([C@@H](CCC(=C)[C@@H]([C@@H]1[C@@]([C@@H]3OC(=O)C)([C@@H](C(=O)O1)C)O)Cl)OC(=O)C)C)CO2)OC(=O)C)OC(=O)[C@@H](C)CC |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| - | - | Junceella juncea | Ref. |
|
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