input word = C00026564

Metabolite InformationStructural formula
Name (+)-Asperazine
Asperazine
Formula C40H36N6O4
Mw 664.27980368
CAS RN 198953-76-3
C_ID C00026564 ,
InChIKey AWMBNXCUMNOLQI-SWOWHPSANA-N
InChICode InChI=1S/C40H36N6O4/c47-35-30(18-23-10-3-1-4-11-23)42-36(48)31(43-35)20-25-22-41-34-26(25)14-9-16-28(34)40-21-33-37(49)44-32(19-24-12-5-2-6-13-24)38(50)46(33)39(40)45-29-17-8-7-15-27(29)40/h1-17,22,30-33,39,41,45H,18-21H2,(H,42,48)(H,43,47)(H,44,49)/t30-,31+,32-,33+,39-,40-/m1/s1
SMILES c1cc2c(c(c1)[C@@]13c4c(cccc4)N[C@@H]1N1[C@@H](C3)C(=O)N[C@@H](C1=O)Cc1ccccc1)[nH]cc2C[C@H]1C(=O)N[C@@H](C(=O)N1)Cc1ccccc1
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus niger Ref.
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