| Name |
Verticillin B |
| Formula |
C30H28N6O7S4 |
| Mw |
712.09023021 |
| CAS RN |
52212-86-9 |
| C_ID |
C00025545
, 
|
| InChIKey |
YABFNIMWFFFBHC-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C30H28N6O7S4/c1-25-21(40)35-19-27(13-8-4-6-10-15(13)31-19,17(38)29(35,46-44-25)23(42)33(25)2)28-14-9-5-7-11-16(14)32-20(28)36-22(41)26(12-37)34(3)24(43)30(36,18(28)39)47-45-26/h4-11,17-20,31-32,37-39H,12H2,1-3H3/t17-,18-,19-,20-,25+,26-,27-,28-,29-,30-/m0/s1 |
| SMILES |
c12c(cccc1)[C@]1([C@@H](N2)N2[C@]3([C@H]1O)C(=O)N([C@@](C2=O)(SS3)C)C)[C@]12c3c(cccc3)N[C@H]1N1[C@]3([C@H]2O)C(=O)N([C@](C1=O)(SS3)CO)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Trp Anthranilate |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Fungi | Plectosphaerellaceae | Verticillium sp. | Ref. |
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