Ojima:PR100965n

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
	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。

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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。

PR100965n	723 C33H39O18	578 C27H30O14	577 C27H29O14	432 C21H20O10	431 C21H19O10	286 C15H10O6	285 C15H9O6
723 C33H39O18
578 C27H30O14	C6H9O4
577 C27H29O14	C6H10O4	H
432 C21H20O10	C12H19O8	C6H10O4	C6H9O4
431 C21H19O10	C12H20O8	C6H11O4	C6H10O4	H
286 C15H10O6	C18H29O12	C12H20O8	C12H19O8	C6H10O4	C6H9O4
285 C15H9O6	C18H30O12	C12H21O8	C12H20O8	C6H11O4	C6H10O4	H

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