input word = C00030177

Metabolite InformationStructural formula
Name Emindole PA
Formula C33H47NO2
Mw 489.36067975
CAS RN 158371-92-7
C_ID C00030177 ,
InChIKey JVKLVZYMLNTAKF-SWAGZQFONA-N
InChICode InChI=1S/C33H47NO2/c1-9-30(2,3)29-23(22-12-10-11-13-26(22)34-29)20-21-14-15-25-24(31(21,4)5)16-17-28-33(25,8)19-18-27(36-28)32(6,7)35/h9-13,16,21,25,27-28,34-35H,1,14-15,17-20H2,2-8H3/t21-,25+,27-,28-,33-/m0/s1
SMILES C=CC(C)(C)c1[nH]c2ccccc2c1C[C@@H]1CC[C@@H]2C(=CC[C@@H]3O[C@H](C(C)(C)O)CC[C@]32C)C1(C)C
Start Substs in Alk. Biosynthesis (Prediction) Indole-3 GGPP
Organism
Kingdom Family Species Reference
--Emericella purpurea Ref.
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