Latest revision as of 13:43, 4 November 2009

All Molecules
KOX PR PBX COX

b-Imidazolelactate

[edit] Top 10 Similar Molecules of b-Imidazolelactate

Ranking	About scoring
KOX00749p Score:26.3 KOX00308p Score:20.07 KOX00056p Score:20.07 KOX00750p Score:17.08 KOX00876p Score:14.53 KOX00793p Score:14.53 KOX00779p Score:14.53 KOX00684p Score:14.53 KOX00313p Score:14.53 KOX00136p Score:14.53	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。

[edit] Links

Page list for each fragment
Pages Related to Peak C5H7N2O: KOX00276p Pages Related to Peak C4H7N2: KOX00056p KOX00062p KOX00086p KOX00136p KOX00215p KOX00229p KOX00306p KOX00308p KOX00313p KOX00684p KOX00723p KOX00749p KOX00750p KOX00779p KOX00791p KOX00793p KOX00802p KOX00843p KOX00876p Pages Related to Peak C4H6N2: KOX00056p KOX00308p KOX00749p KOX00750p KOX00782p Pages Related to Peak C4H5N2: KOX00056p KOX00062p KOX00086p KOX00111p KOX00136p KOX00162p KOX00197p KOX00215p KOX00308p KOX00313p KOX00420p KOX00427p KOX00443p KOX00526p KOX00588p KOX00590p KOX00596p KOX00606p KOX00608p KOX00684p KOX00721p KOX00746p KOX00749p KOX00750p KOX00756p KOX00779p KOX00780p KOX00782p KOX00791p KOX00793p KOX00803p KOX00846p KOX00876p KOX00881p KOX00897p KOX00911p KOX00913p Pages Related to Peak C3H6N: KOX00022p KOX00041p KOX00051p KOX00056p KOX00062p KOX00064p KOX00069p KOX00079p KOX00095p KOX00136p KOX00167p KOX00225p KOX00229p KOX00236p KOX00254p KOX00259p KOX00268p KOX00270p KOX00276p KOX00281p KOX00308p KOX00313p KOX00343p KOX00347p KOX00364p KOX00393p KOX00406p KOX00420p KOX00454p KOX00476p KOX00508p KOX00514p KOX00529p KOX00586p KOX00590p KOX00593p KOX00623p KOX00636p KOX00640p KOX00648p KOX00662p KOX00680p KOX00681p KOX00684p KOX00687p KOX00688p KOX00698p KOX00700p KOX00702p KOX00713p KOX00723p KOX00729p KOX00733p KOX00743p KOX00749p KOX00762p KOX00769p KOX00778p KOX00779p KOX00793p KOX00802p KOX00803p KOX00808p KOX00822p KOX00827p KOX00838p KOX00856p KOX00874p KOX00875p KOX00876p KOX00887p KOX00888p KOX00890p KOX00900p KOX00905p KOX00911p Pages Related to Peak C3H5N: KOX00698p KOX00749p Pages Related to Peak C3H4N: KOX00032p KOX00056p KOX00062p KOX00086p KOX00111p KOX00118p KOX00126p KOX00136p KOX00181p KOX00215p KOX00251p KOX00254p KOX00308p KOX00313p KOX00427p KOX00429p KOX00443p KOX00512p KOX00526p KOX00588p KOX00590p KOX00606p KOX00608p KOX00639p KOX00684p KOX00698p KOX00713p KOX00721p KOX00746p KOX00749p KOX00750p KOX00756p KOX00779p KOX00780p KOX00791p KOX00793p KOX00799p KOX00802p KOX00803p KOX00846p KOX00876p KOX00878p KOX00911p KOX00913p

[edit] Annotations

Precursor	Product	Comments
C6H9N2O3 (157)	C5H7N2O (111)	a
C6H9N2O3 (157)	C4H7N2 (83)	b
C6H9N2O3 (157)	C4H6N2 (82)	b,rad.
C6H9N2O3 (157)	C4H5N2 (81)	b
C5H7N2O (111)	C4H7N2 (83)	IT
C5H7N2O (111)	C4H6N2 (82)	IT

[edit] 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。

KOX00761p	157 C6H9N2O3	111 C5H7N2O	83 C4H7N2	82 C4H6N2	81 C4H5N2	56 C3H6N	55 C3H5N	54 C3H4N
157 C6H9N2O3
111 C5H7N2O	CH2O2
83 C4H7N2	C2H2O3	CO
82 C4H6N2	C2H3O3	CHO	H
81 C4H5N2	C2H4O3	CH2O	H2	H
56 C3H6N	C3H3NO3	C2HNO	CHN	CN
55 C3H5N	C3H4NO3	C2H2NO	CH2N	CHN	CN	H
54 C3H4N	C3H5NO3	C2H3NO	CH3N	CH2N	CHN	H2	H

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

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

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 &&C6H9N2O3&&C5H7N2O&&C4H7N2&&C4H6N2&&C4H5N2&&C3H6N&&C3H5N&&C3H4N&&
-&&C6H9N2O3: C5H7N2O C4H7N2 C4H6N2 C4H5N2
+&&C6H9N2O3: C5H7N2O
-&&C5H7N2O: C4H7N2 C4H6N2 C4H5N2
+a
-&&C4H7N2: C3H6N C3H5N C3H4N
+&&C6H9N2O3: C4H7N2
-&&C4H6N2: C3H6N C3H5N C3H4N
+b
+&&C6H9N2O3: C4H6N2
+b,rad.
+&&C6H9N2O3: C4H5N2
+b
+&&C6H9N2O3: C3H6N** C3H5N** C3H4N**
+&&C5H7N2O: C4H7N2
+IT
+&&C5H7N2O: C4H6N2
+IT
+&&C5H7N2O: C4H5N2 C3H6N** C3H5N** C3H4N**
+&&C4H7N2: C4H6N2* C4H5N2* C3H6N C3H5N C3H4N
+&&C4H6N2: C4H5N2* C3H6N C3H5N C3H4N
 &&C4H5N2: C3H5N C3H4N
+&&C3H6N: C3H5N* C3H4N*
+&&C3H5N: C3H4N*
 }}

IDs and Links
MassBank	b-Imidazolelactate
CAS
Keio ID	I053+

MassBank:KOX00761p

Latest revision as of 13:43, 4 November 2009

Contents

[edit] Top 10 Similar Molecules of b-Imidazolelactate

[edit] Links

[edit] Annotations

[edit] Precursor-Product Relationship

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