Ojima:KO008968p

General Index

All Molecules KOX PR PBX COX

Ion Frequency

Prec.-Product

Neutral Loss

Help

150px

IDs and Links
MassBank	[1]
CAS
Keio ID

Top 10 Similar Molecules of

[show] Ranking	About scoring
G021+ Score:43.98 G065+ Score:24.07 M082+ Score:17.83 M081+ Score:17.83 G051+ Score:17.83 G046+ Score:17.83 A191+ Score:17.83 A122+ Score:17.83 R016+ Score:12.9 M067+ Score:9.13	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

[show] Page list for each fragment

Pages Related to Peak C6H15NO8P:   G065+  G021+   Pages Related to Peak C6H13NO7P:   G021+   Pages Related to Peak C6H11NO6P:   G021+   Pages Related to Peak C6H9NO5P:   G021+   Pages Related to Peak C6H10NO3:   A031+  A065+  A110+  A122+  A191+  G065+  M067+  R016+  G021+  G046+  G051+  M081+  M082+   Pages Related to Peak C6H8NO2:   A122+  A191+  E011+  G065+  E008+  G021+  G046+  G051+  M081+  M082+   Pages Related to Peak C5H8NO:   A065+  A110+  A122+  A191+  B019+  G065+  M067+  M159+  R016+  B026+  C043+  G021+  G046+  G051+  M081+  M082+  S044+   Pages Related to Peak C4H6NO:   A031+  A122+  A191+  E005+  F034+  G005+  G018+  G019+  G043+  G062+  G065+  G117+  L016+  M114+  O008+  P092+  R016+  T010+  T014+  T015+  T020+  D038+  D061+  D183+  E056+  G006+  G021+  G046+  G051+  M025+  M081+  M082+  S044+  A204+

Annotations

Precursor-Product Relationship

[show] 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。

[hide] KO008968p	260 C6H15NO8P	242 C6H13NO7P	224 C6H11NO6P	206 C6H9NO5P	144 C6H10NO3	126 C6H8NO2	98 C5H8NO	84 C4H6NO
260 C6H15NO8P
242 C6H13NO7P	H2O
224 C6H11NO6P	H4O2	H2O
206 C6H9NO5P	H6O3	H4O2	H2O
144 C6H10NO3	H5O5P	H3O4P	HO3P
126 C6H8NO2	H7O6P	H5O5P	H3O4P	HO3P	H2O
98 C5H8NO	CH7O7P	CH5O6P	CH3O5P	CHO4P	CH2O2	CO
84 C4H6NO	C2H9O7P	C2H7O6P	C2H5O5P	C2H3O4P	C2H4O2	C2H2O	CH2

(pos/neg)<<First Page   (pos/neg)<Previous Page

Next Page>(pos/neg)   Last Page>>(pos/neg)