Ojima:PR101020p

General Index

All Molecules KOX PR PBX COX

Ion Frequency

Prec.-Product

Neutral Loss

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Kaempferol-3-Rhamnoside-4-Rhamnoside-7-Rhamnoside

IDs and Links
MassBank	Kaempferol-3-Rhamnoside-4-Rhamnoside-7-Rhamnoside
CAS	129369-23-9
Keio ID

Top 10 Similar Molecules of Kaempferol-3-Rhamnoside-4-Rhamnoside-7-Rhamnoside

Ranking	About scoring
M011+ Score:15.52 S049+ Score:15.52 B090+ Score:5.94 A224+ Score:5.94 I015+ Score:5.94 F008+ Score:5.94 A155+ Score:5.54 A064+ Score:5.54 F034+ Score:5.54 A204+ Score:4.03	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 C6H9O3:   F034+  S049+  A064+  M011+  A155+   Pages Related to Peak C6H7O2:   I015+  S049+  M011+   Pages Related to Peak C4H5O2:   A007+  A031+  A059+  E005+  G003+  G005+  G019+  G020+  G043+  G061+  G065+  M067+  M080+  P067+  S049+  A143+  C041+  D038+  D083+  E056+  G046+  G051+  M011+  M081+  M082+  A204+   Pages Related to Peak C4H7O:   F008+  A224+  B090+

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。

PR101020p	725 C33H41O18	579 C27H31O14	433 C21H21O10	287 C15H11O6	239 C12H15O5	129 C6H9O3	111 C6H7O2	85 C4H5O2	71 C4H7O
725 C33H41O18
579 C27H31O14	C6H10O4
433 C21H21O10	C12H20O8	C6H10O4
287 C15H11O6	C18H30O12	C12H20O8	C6H10O4
239 C12H15O5	C21H26O13	C15H16O9	C9H6O5
129 C6H9O3	C27H32O15	C21H22O11	C15H12O7	C9H2O3	C6H6O2
111 C6H7O2	C27H34O16	C21H24O12	C15H14O8	C9H4O4	C6H8O3	H2O
85 C4H5O2	C29H36O16	C23H26O12	C17H16O8	C11H6O4	C8H10O3	C2H4O	C2H2
71 C4H7O	C29H34O17	C23H24O13	C17H14O9	C11H4O5	C8H8O4	C2H2O2	C2O

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