Ojima:COX00078p

General Index

All Molecules KOX PR PBX COX

Ion Frequency

Prec.-Product

Neutral Loss

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Reserpine

IDs and Links
MassBank	Reserpine
CAS
Keio ID

Top 10 Similar Molecules of Reserpine

Ranking	About scoring
P061+ Score:5.38 M103+ Score:5.38 B026+ Score:5.38 M053+ Score:5.38 M040+ Score:5.38 H027+ Score:5.38	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 C11H12NO:   H027+  M040+  M053+  B026+  M103+  P061+

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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。

COX00078p	609 C33H41N2O9	397 C23H29N2O4	365 C22H25N2O3	195 C10H11O4	174 C11H12NO
609 C33H41N2O9
397 C23H29N2O4	C10H12O5
365 C22H25N2O3	C11H16O6	CH4O
195 C10H11O4	C23H30N2O5	C13H18N2
174 C11H12NO	C22H29NO8	C12H17NO3	C11H13NO2

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