Ojima:COX00092p

General Index

All Molecules KOX PR PBX COX

Ion Frequency

Prec.-Product

Neutral Loss

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Testosterone_Propionate

IDs and Links
MassBank	Testosterone_Propionate
CAS
Keio ID

Top 10 Similar Molecules of Testosterone_Propionate

Ranking	About scoring
G075+ Score:18.66 E013+ Score:15 A053+ Score:9.84 N028+ Score:9.62 M039+ Score:9.28 A061+ Score:9.28 L057+ Score:5.94 L003+ Score:5.94 D185+ Score:5.72 P059+ Score:5.72	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 C19H27O:   G075+   Pages Related to Peak C13H19:   G075+   Pages Related to Peak C7H9O:   P059+  D185+  E013+  N028+   Pages Related to Peak C6H9O:   A053+  L003+  L057+   Pages Related to Peak C6H9:   C040+  G075+  A061+  D078+  E013+  M039+   Pages Related to Peak C6H7:   A053+  A067+  B020+  C063+  E012+  E033+  M127+  P002+  P113+  A035+  A061+  B009+  B090+  D032+  D039+  D178+  D180+  E013+  L031+  M039+  M082+  M167+  N028+  P047+  P061+  S040+  T041+  T060+  T126+  A082+   Pages Related to Peak C3H5O:   C119+  S049+  T010+  T020+  A046+  A143+  A194+  D183+  M025+  S044+  U006+  G030+

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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。

COX00092p	345 C22H33O3	289 C19H29O2	271 C19H27O	253 C19H25	175 C13H19	109 C7H9O	97 C6H9O	81 C6H9	79 C6H7	57 C3H5O
345 C22H33O3
289 C19H29O2	C3H4O
271 C19H27O	C3H6O2	H2O
253 C19H25	C3H8O3	H4O2	H2O
175 C13H19	C9H14O3	C6H10O2	C6H8O	C6H6
109 C7H9O	C15H24O2	C12H20O	C12H18
97 C6H9O	C16H24O2	C13H20O	C13H18			C
81 C6H9	C16H24O3	C13H20O2	C13H18O	C13H16	C7H10	CO	O
79 C6H7	C16H26O3	C13H22O2	C13H20O	C13H18	C7H12	CH2O	H2O	H2
57 C3H5O	C19H28O2	C16H24O	C16H22			C4H4	C3H4

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