| Name |
Septocylindrin A |
| Formula |
C94H155N23O25 |
| Mw |
2006.15644767 |
| CAS RN |
933470-92-9 |
| C_ID |
C00040278
, 
|
| InChIKey |
KYDAQHIPEIKSPP-XRUAACPDNA-N |
| InChICode |
InChI=1S/C94H155N23O25/c1-49(2)45-60(74(130)111-94(24,25)86(142)116-42-29-33-61(116)75(131)106-67(50(3)4)77(133)114-92(20,21)84(140)115-91(18,19)82(138)105-58(37-40-66(123)124)72(128)104-57(35-38-63(95)120)71(127)101-56(47-97-41-44-118)46-55-31-27-26-28-32-55)102-65(122)48-98-79(135)87(10,11)113-78(134)68(51(5)6)107-83(139)90(16,17)110-73(129)59(36-39-64(96)121)103-69(125)52(7)99-80(136)88(12,13)109-70(126)53(8)100-81(137)89(14,15)112-76(132)62-34-30-43-117(62)85(141)93(22,23)108-54(9)119/h26-28,31-32,49-53,56-62,67-68,97,118H,29-30,33-48H2,1-25H3,(H2,95,120)(H2,96,121)(H,98,135)(H,99,136)(H,100,137)(H,101,127)(H,102,122)(H,103,125)(H,104,128)(H,105,138)(H,106,131)(H,107,139)(H,108,119)(H,109,126)(H,110,129)(H,111,130)(H,112,132)(H,113,134)(H,114,133)(H,115,140)(H,123,124)/t52-,53-,56-,57+,58-,59-,60-,61-,62-,67-,68-/m0/s1 |
| SMILES |
C1CC[C@H](N1C(=O)C(NC(=O)C)(C)C)C(=O)NC(C(=O)N[C@@H](C)C(=O)NC(C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N)C(=O)NC(C(=O)N[C@@H](C(C)C)C(=O)NC(C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NC(C(=O)N1[C@@H](CCC1)C(=O)N[C@H](C(=O)NC(C(=O)NC(C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C(=O)N[C@@H](Cc1ccccc1)CNCCO)CCC(=O)N)(C)C)(C)C)C(C)C)(C)C)(C)C)(C)C)(C)C)(C)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Lys L-Arg L-Ala L-Asp |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| - | - | Septocylindrium sp. | Ref. |
|
|
zoom in
| Organism | Septocylindrium sp. |
|---|
| Reference | Summers,J.Nat.Prod.,70,(2007),391 |
|---|
|
