| Name |
alpha-Ergocryptine |
| Formula |
C32H41N5O5 |
| Mw |
575.31076946 |
| CAS RN |
511-09-1 |
| C_ID |
C00001721
, 
|
| InChIKey |
YDOTUXAWKBPQJW-NIPLTTASNA-N |
| InChICode |
InChI=1S/C32H41N5O5/c1-17(2)12-25-29(39)36-11-7-10-26(36)32(41)37(25)30(40)31(42-32,18(3)4)34-28(38)20-13-22-21-8-6-9-23-27(21)19(15-33-23)14-24(22)35(5)16-20/h6,8-9,13,15,17-18,20,24-26,33,41H,7,10-12,14,16H2,1-5H3,(H,34,38)/t20-,24-,25+,26+,31-,32+/m1/s1 |
| SMILES |
[C@H]12[C@]3(N([C@H](C(=O)N1CCC2)CC(C)C)C(=O)[C@@](O3)(NC(=O)[C@@H]1C=C2[C@H](N(C1)C)Cc1c3c2cccc3[nH]c1)C(C)C)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Trp L-Pro IPP |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Fungi | Clavicipitaceae | Claviceps grohii | Ref. |
| Fungi | Clavicipitaceae | Claviceps purpurea  | Ref. |
|
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