| Name |
8-alpha-Hydroxy-alpha-ergokryptine
8-Hydroxy-alpha-ergokryptine |
| Formula |
C32H41N5O6 |
| Mw |
591.30568408 |
| CAS RN |
186805-44-7 |
| C_ID |
C00026552
, 
|
| InChIKey |
MXACNXIDKMEXQX-OIIVABSPNA-N |
| InChICode |
InChI=1S/C32H41N5O6/c1-6-18(4)26-27(38)36-12-8-11-24(36)32(42)37(26)29(40)31(43-32,17(2)3)34-28(39)30(41)14-21-20-9-7-10-22-25(20)19(15-33-22)13-23(21)35(5)16-30/h7,9-10,14-15,17-18,23-24,26,33,41-42H,6,8,11-13,16H2,1-5H3,(H,34,39)/t18-,23+,24-,26-,30-,31+,32-/m0/s1 |
| SMILES |
CCC(C)[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@]3(O)C=C4c5cccc6[nH]cc(c56)C[C@H]4N(C)C3)(C(C)C)C(=O)N12 |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Trp L-Pro IPP |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Fungi | Clavicipitaceae | Claviceps purpurea  | Ref. |
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