| Name |
Neoatroviridin B |
| Formula |
C82H144N20O21 |
| Mw |
1745.08149181 |
| CAS RN |
460060-38-2 |
| C_ID |
C00015056
, 
|
| InChIKey |
KHLMTTNTKUDZDO-VSIRVKOCNA-N |
| InChICode |
InChI=1S/C82H144N20O21/c1-27-81(25,99-65(114)53(38-45(7)8)89-60(109)47(11)87-58(107)40-85-67(116)75(13,14)94-48(12)104)72(121)92-51(32-34-57(84)106)62(111)96-77(17,18)69(118)93-54(39-46(9)10)64(113)97-76(15,16)68(117)86-41-59(108)95-82(26,28-2)73(122)101-80(23,24)74(123)102-35-29-30-55(102)66(115)90-52(37-44(5)6)63(112)98-79(21,22)71(120)100-78(19,20)70(119)91-50(31-33-56(83)105)61(110)88-49(42-103)36-43(3)4/h43-47,49-55,103H,27-42H2,1-26H3,(H2,83,105)(H2,84,106)(H,85,116)(H,86,117)(H,87,107)(H,88,110)(H,89,109)(H,90,115)(H,91,119)(H,92,121)(H,93,118)(H,94,104)(H,95,108)(H,96,111)(H,97,113)(H,98,112)(H,99,114)(H,100,120)(H,101,122)/t47-,49+,50-,51-,52-,53-,54-,55-,81+,82+/m0/s1 |
| SMILES |
C(C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@](C)(C(=O)N[C@@H](CCC(=O)N)C(=O)NC(C(=O)N[C@@H](CC(C)C)C(=O)NC(C)(C)C(=O)NCC(=O)N[C@](C(=O)NC(C)(C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CO)CC(C)C)(C)CC)(C)C)CC)NC(=O)C(C)(C)NC(=O)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Pro L-Lys L-Arg L-Ala |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Fungi | Hypocreaceae | Trichoderma atroviride F80317 | Ref. |
|
|
zoom in
| Organism | Trichoderma atroviride F80317 |
|---|
| Reference | Oh,J.Antibiotics 55,(2002),557 |
|---|
|
