| Name |
Iturin C3 |
| Formula |
C50H77N11O15 |
| Mw |
1071.56006087 |
| CAS RN |
164740-75-4 |
| C_ID |
C00016471
, 
|
| InChIKey |
QUXLPJFBZHRAAF-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C50H77N11O15/c1-28(2)12-9-7-5-3-4-6-8-10-13-30-23-42(67)55-36(26-43(68)69)47(73)57-33(22-29-15-17-31(63)18-16-29)44(70)58-34(24-40(52)65)45(71)56-32(19-20-39(51)64)50(76)61-21-11-14-38(61)49(75)59-35(25-41(53)66)46(72)60-37(27-62)48(74)54-30/h15-18,28,30,32-38,62-63H,3-14,19-27H2,1-2H3,(H2,51,64)(H2,52,65)(H2,53,66)(H,54,74)(H,55,67)(H,56,71)(H,57,73)(H,58,70)(H,59,75)(H,60,72)(H,68,69)/t30-,32-,33+,34-,35+,36+,37-,38+/m0/s1 |
| SMILES |
C1C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N2[C@@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H]1CCCCCCCCCCC(C)C)CO)CC(=O)N)CCC2)CCC(=O)N)CC(=O)N)Cc1ccc(cc1)O)CC(=O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Pro L-Lys |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Bacteria | Bacillaceae | Bacillus sp. A2822 | Ref. |
|
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