Ojima:COX00035p

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Neutral Loss

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Ergocristine

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MassBank	Ergocristine
CAS
Keio ID

Top 10 Similar Molecules of Ergocristine

Ranking	About scoring
C133+ Score:6.64	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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Pages Related to Peak C16H18N3O:   C133+

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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。

COX00035p	610 C35H40N5O5	592 C35H38N5O4	348 C21H22N3O2	325 C19H21N2O3	268 C16H18N3O	223 C15H15N2
610 C35H40N5O5
592 C35H38N5O4	H2O
348 C21H22N3O2	C14H18N2O3	C14H16N2O2
325 C19H21N2O3	C16H19N3O2	C16H17N3O
268 C16H18N3O	C19H22N2O4	C19H20N2O3	C5H4O
223 C15H15N2	C20H25N3O5	C20H23N3O4	C6H7NO2	C4H6O3	CH3NO

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