input word = C00050043

Metabolite InformationStructural formula
Name Cryptophycin 46
Formula C35H43ClN2O7
Mw 638.27587945
CAS RN 162679-35-8
C_ID C00050043 ,
InChIKey QLGFKEFRTAOKJU-KTFGATILNA-N
InChICode InChI=1S/C35H43ClN2O7/c1-22(2)18-31-35(42)44-29(23(3)14-15-25-10-7-6-8-11-25)12-9-13-32(39)38-28(33(40)37-21-24(4)34(41)45-31)20-26-16-17-30(43-5)27(36)19-26/h6-11,13-17,19,22-24,28-29,31H,12,18,20-21H2,1-5H3,(H,37,40)(H,38,39)/b13-9+,15-14+/t23-,24-,28+,29+,31+/m1/s1
SMILES O1C(=O)[C@@H](OC(=O)[C@@H](CNC(=O)[C@@H](NC(=O)/C=C/C[C@H]1[C@@H](/C=C/c1ccccc1)C)Cc1cc(c(cc1)OC)Cl)C)CC(C)C
Start Substs in Alk. Biosynthesis (Prediction) Anthranilate
Organism
Kingdom Family Species Reference
BacteriaNostocaceaeNostoc sp. GSV 244 Ref.
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