MSI_000011847

Unreliable

排名分数: 0.69
参考来源: Bathymodiolus (UBERON:2000211: gill lamella)

M/z: 987.6411
Mass Window: 987.641 ~ 987.6411 (0.4 ppm)

参考注释

(2r,3s,5r)-8-amino-n-[(1r)-1-{[(1s)-1-{[(1r,2r)-2-amino-1-{[(2s,3r,5s)-6-{[(1s)-1-{[({3-[(4-aminobutyl)amino]propyl}-c-hydroxycarbonimidoyl)methyl]-c-hydroxycarbonimidoyl}-2-(methylamino)ethyl]-c-hydroxycarbonimidoyl}-1,3,5-trihydroxyhexan-2-yl]-c-hydroxycarbonimidoyl}-5-carbamimidamidopentyl]-c-hydroxycarbonimidoyl}-2-(methylamino)ethyl]-c-hydroxycarbonimidoyl}ethyl]-2,3,5-trihydroxyoctanimidic acid_[M+H-2H2O]+ (BioDeep_00002135729)
(2r,3s,5r)-8-amino-n-[(1r)-1-{[(1s)-1-{[(1r,2r)-2-amino-1-{[(2s,3r,5s)-6-{[(1s)-1-{[({3-[(4-aminobutyl)amino]propyl}-c-hydroxycarbonimidoyl)methyl]-c-hydroxycarbonimidoyl}-2-(methylamino)ethyl]-c-hydroxycarbonimidoyl}-1,3,5-trihydroxyhexan-2-yl]-c-hydroxycarbonimidoyl}-5-carbamimidamidopentyl]-c-hydroxycarbonimidoyl}-2-(methylamino)ethyl]-c-hydroxycarbonimidoyl}ethyl]-2,3,5-trihydroxyoctanimidic acid

Formula: C42H86N16O13 (1022.6559946)
SMILES:

CNC[C@H](N=C(O)C[C@@H](O)C[C@@H](O)[C@H](CO)N=C(O)[C@H](N=C(O)[C@H](CNC)N=C(O)[C@@H](C)N=C(O)[C@H](O)[C@@H](O)C[C@H](O)CCCN)[C@H](N)CCCNC(=N)N)C(O)=NCC(O)=NCCCNCCCCN