| SpectraBase Spectrum ID |
LaP0YtiTRxU |
| Name |
(2S,5R,7S,8R,2E,4E)-Tricarbonyl-{.eta(4).-(2->5)-8-[(t-butoxycarbonyl)amino]-7-methoxynona-2,4-dienal]-iron |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H25FeNO7 |
| InChI |
InChI=1S/C15H25NO4.3CO.Fe/c1-12(16-14(18)20-15(2,3)4)13(19-5)10-8-6-7-9-11-17;3*1-2;/h6-9,11-13H,10H2,1-5H3,(H,16,18);;;;/t12-,13+;;;;/m1..../s1 |
| InChIKey |
HFWQIZRZKKLCJH-XWZLFUPLSA-N |
| Molecular Weight |
423.243 g/mol |
| SMILES |
N(C(OC(C)(C)C)=O)[C@@]([C@](CC1[Fe]23(C(C13)C2C=O)(C#[O])(C#[O])C#[O])(OC)[H])(C)[H] |
| SPLASH |
splash10-0a4r-9006000000-e16f0aabc203a483d610 |
| Source of Spectrum |
C-121-9153-21 |
| Wiley ID |
1700319 |
![(2S,5R,7S,8R,2E,4E)-Tricarbonyl-{.eta(4).-(2->5)-8-[(t-butoxycarbonyl)amino]-7-methoxynona-2,4-dienal]-iron](/api/spectrum/LaP0YtiTRxU/structure.png?h=300&w=458 "(2S,5R,7S,8R,2E,4E)-Tricarbonyl-{.eta(4).-(2->5)-8-[(t-butoxycarbonyl)amino]-7-methoxynona-2,4-dienal]-iron")
