| Name |
Mancinellin |
| Formula |
C36H52O8 |
| Mw |
612.36621864 |
| CAS RN |
57672-76-1 |
| C_ID |
C00003451
, 
|
| InChIKey |
NEZVVESVXBEHTR-SZYWTWLZNA-N |
| InChICode |
InChI=1S/C36H52O8/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-26(38)43-34-21-24(3)35(41)25-20-23(2)29(39)36(25,42)31(40)33(22-37)30(44-33)27(35)28(34)32(34,4)5/h14-20,24-25,27-28,30-31,37,40-42H,6-13,21-22H2,1-5H3/b15-14+,17-16+,19-18+/t24-,25+,27-,28-,30+,31-,33+,34+,35-,36-/m1/s1 |
| SMILES |
[C@@]12([C@@H]([C@@]3([C@H]([C@@H]4[C@]([C@@H]1C=C(C2=O)C)([C@@H](C[C@@]1([C@H]4C1(C)C)OC(=O)/C=C/C=C/C=C/CCCCCCCCC)C)O)O3)CO)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Euphorbiaceae | Hippomane mancinella  | Ref. |
|
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