Ojima:KOX00290p

総索引

分子リスト KOX PR PBX COX

イオン統計

前駆-生成イオン統計

中性脱離分子統計

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N-Glycolylneuraminate

IDs and Links
MassBank	N-Glycolylneuraminate
CAS
Keio ID	G062+

Top 10 Similar Molecules of N-Glycolylneuraminate

Ranking	About scoring
G062+ Score:82.36 A018+ Score:50.27 D037+ Score:5.53 G050+ Score:5.53 G037+ Score:5.53 G011+ Score:5.53	The similarity score between two molecules is defined as the sum of Shannon entropy of ionic formulas shared by the molecules: $\textstyle - \sum_{p\in shared} \log(\mbox{frequency}(p))$ 代謝物間の類似度スコアは、それらのスペクトルで共有される（アノテートされた）イオン式のシャノン情報量の総和です。

Links

Page list for each fragment

Pages Related to Peak C11H20NO10:   G062+   Pages Related to Peak C11H18NO9:   G062+   Pages Related to Peak C11H16NO8:   G062+   Pages Related to Peak C11H14NO7:   G062+   Pages Related to Peak C11H12NO6:   G062+   Pages Related to Peak C9H14NO6:   A018+  G062+   Pages Related to Peak C9H11O6:   A018+  G062+   Pages Related to Peak C9H12NO5:   A018+   Pages Related to Peak C9H9O5:   A018+  G062+   Pages Related to Peak C9H7O4:   A018+  G062+   Pages Related to Peak C8H7O4:   A018+  G062+   Pages Related to Peak C8H7O3:   A018+  G062+   Pages Related to Peak C7H5O2:   A018+  G062+   Pages Related to Peak C2H6NO2:   G011+  G037+  G050+  G062+  D037+

Annotations

Precursor-Product Relationship

About the PP Table (行列表示について)
The matrix is viewed columnwise. The topmost precursor ion in bold face produces the product ions beneath it. Each formula in matrix cells corresponds to the neutral loss. Blackout cells indicate products that cannot be derived, and orange cells indicate a structurally plausible link produced by cleaving a single chemical bond (in cases of ring-opening, two bonds).	行列は列方向に見ます。最上段太字の前駆イオン(precursor ion)が直下の生成イオン群(product ions)になると解釈します。 行列要素に書かれている組成式はニュートラルロスです。黒は前駆イオンから生成しえない関係、オレンジは分子構造における共有結合1本の切断（開環の場合は2本）で生じる関係を意味します。

KOX00290p	326 C11H20NO10	308 C11H18NO9	290 C11H16NO8	272 C11H14NO7	254 C11H12NO6	232 C9H14NO6	215 C9H11O6	214 C9H12NO5	197 C9H9O5	188 C7H10NO5	179 C9H7O4	167 C8H7O4	151 C8H7O3	121 C7H5O2	112 C5H6NO2	76 C2H6NO2
326 C11H20NO10
308 C11H18NO9	H2O
290 C11H16NO8	H4O2	H2O
272 C11H14NO7	H6O3	H4O2	H2O
254 C11H12NO6	H8O4	H6O3	H4O2	H2O
232 C9H14NO6	C2H6O4	C2H4O3	C2H2O2	C2O
215 C9H11O6	C2H9NO4	C2H7NO3	C2H5NO2	C2H3NO	C2HN	H3N
214 C9H12NO5	C2H8O5	C2H6O4	C2H4O3	C2H2O2	C2O	H2O
197 C9H9O5	C2H11NO5	C2H9NO4	C2H7NO3	C2H5NO2	C2H3NO	H5NO	H2O	H3N
188 C7H10NO5	C4H10O5	C4H8O4	C4H6O3	C4H4O2	C4H2O	C2H4O		C2H2
179 C9H7O4	C2H13NO6	C2H11NO5	C2H9NO4	C2H7NO3	C2H5NO2	H7NO2	H4O2	H5NO	H2O
167 C8H7O4	C3H13NO6	C3H11NO5	C3H9NO4	C3H7NO3	C3H5NO2	CH7NO2	CH4O2	CH5NO	CH2O		C
151 C8H7O3	C3H13NO7	C3H11NO6	C3H9NO5	C3H7NO4	C3H5NO3	CH7NO3	CH4O3	CH5NO2	CH2O2		CO	O
121 C7H5O2	C4H15NO8	C4H13NO7	C4H11NO6	C4H9NO5	C4H7NO4	C2H9NO4	C2H6O4	C2H7NO3	C2H4O3	H5NO3	C2H2O2	CH2O2	CH2O
112 C5H6NO2	C6H14O8	C6H12O7	C6H10O6	C6H8O5	C6H6O4	C4H8O4		C4H6O3		C2H4O3
76 C2H6NO2	C9H14O8	C9H12O7	C9H10O6	C9H8O5	C9H6O4	C7H8O4		C7H6O3		C5H4O3					C3

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