MassBank:KOX00286p

General Index

All Molecules KOX PR PBX COX

Ion Frequency

Prec.-Product

Neutral Loss

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Glycyrrhizate

IDs and Links
MassBank	Glycyrrhizate
CAS	1405-86-3
Keio ID	G057+

Top 10 Similar Molecules of Glycyrrhizate

Ranking	About scoring
KOX00298p Score:13.27	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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Page list for each fragment
Pages Related to Peak C30H47O4:   KOX00298p   Pages Related to Peak C30H45O3:   KOX00298p

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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。

KOX00286p	823 C42H63O16	647 C36H55O10	471 C30H47O4	453 C30H45O3
823 C42H63O16
647 C36H55O10	C6H8O6
471 C30H47O4	C12H16O12	C6H8O6
453 C30H45O3	C12H18O13	C6H10O7	H2O

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