Ojima:KOX00286p

General Index

All Molecules KOX PR PBX COX

Ion Frequency

Prec.-Product

Neutral Loss

Help

Glycyrrhizate

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

Top 10 Similar Molecules of Glycyrrhizate

Ranking	About scoring
G075+ Score:32.37 G057+ Score:25.74	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 C42H63O16:   G057+   Pages Related to Peak C36H55O10:   G057+   Pages Related to Peak C30H47O4:   G057+  G075+   Pages Related to Peak C30H45O3:   G057+  G075+   Pages Related to Peak C14H21:   G075+   Pages Related to Peak C13H21:   G075+   Pages Related to Peak C12H17:   G075+

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。

KOX00286p	823 C42H63O16	647 C36H55O10	471 C30H47O4	453 C30H45O3	217 C15H21O	189 C14H21	177 C13H21	161 C12H17
823 C42H63O16
647 C36H55O10	C6H8O6
471 C30H47O4	C12H16O12	C6H8O6
453 C30H45O3	C12H18O13	C6H10O7	H2O
217 C15H21O	C27H42O15	C21H34O9	C15H26O3	C15H24O2
189 C14H21	C28H42O16	C22H34O10	C16H26O4	C16H24O3	CO
177 C13H21	C29H42O16	C23H34O10	C17H26O4	C17H24O3	C2O	C
161 C12H17	C30H46O16	C24H38O10	C18H30O4	C18H28O3	C3H4O	C2H4	CH4

(pos/neg)<<First Page   (pos/neg)<Previous Page

Next Page>(pos/neg)   Last Page>>(pos/neg)