input word = C00054299

Metabolite InformationStructural formula
Name Chaetoglobosin N
Formula C33H38N2O5
Mw 542.27807234
CAS RN 156980-59-5
C_ID C00054299
InChIKey KPZHIOQEYKRXQD-POYXQPPFSA-N
InChICode InChI=1S/C33H38N2O5/c1-17-9-8-11-23-30-32(5,40-30)20(4)27-28(19(3)22-16-34-24-12-7-6-10-21(22)24)35-31(39)33(23,27)26(37)14-13-25(36)29(38)18(2)15-17/h6-8,10-12,15-17,19-20,23,27-28,30,34H,9,13-14H2,1-5H3,(H,35,39)/b11-8+,18-15+/t17-,19+,20-,23-,27-,28-,30-,32+,33+/m0/s1
SMILES C/C1=C[C@@H](C)C/C=C/[C@H]2[C@@H]3O[C@]3(C)[C@@H](C)[C@H]3[C@H]([C@H](C)c4c[nH]c5ccccc45)NC(=O)[C@]32C(=O)CCC(=O)C1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiValsaceaePhomopsis leptostromiformis Ref.
PlantaePoaceaeZea mays Ref.
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