input word = C00016946

Metabolite InformationStructural formula
Name Q 20547A
Win 64821
Formula C40H36N6O4
Mw 664.27980368
CAS RN 150881-27-9
C_ID C00016946 ,
InChIKey ZEANERNKMXBETI-MLVJSWTKNA-N
InChICode InChI=1S/C40H36N6O4/c47-33-31-21-39(25-15-7-9-17-27(25)43-37(39)45(31)35(49)29(41-33)19-23-11-3-1-4-12-23)40-22-32-34(48)42-30(20-24-13-5-2-6-14-24)36(50)46(32)38(40)44-28-18-10-8-16-26(28)40/h1-18,29-32,37-38,43-44H,19-22H2,(H,41,47)(H,42,48)/t29-,30-,31-,32-,37+,38+,39-,40-/m0/s1
SMILES [C@H]1(NC(=O)[C@H]2N(C1=O)[C@@H]1[C@](C2)(c2c(N1)cccc2)[C@]12C[C@H]3C(=O)N[C@H](C(=O)N3[C@H]1Nc1c2cccc1)Cc1ccccc1)Cc1ccccc1
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus sp. SC319 Ref.
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