Ojima:KOX00199p

General Index

All Molecules KOX PR PBX COX

Ion Frequency

Prec.-Product

Neutral Loss

Help

3,5-Diiodo-tyrosine

IDs and Links
MassBank	3,5-Diiodo-tyrosine
CAS	300-39-0 66-02-4
Keio ID	D056+

Top 10 Similar Molecules of 3,5-Diiodo-tyrosine

Ranking	About scoring
D056+ Score:55.78 S058+ Score:9.31 N028+ Score:9.31 M167+ Score:9.31 I050+ Score:9.31 H050+ Score:5.02 P113+ Score:5.02 P053+ Score:5.02 M127+ Score:5.02 V021+ Score:4.28	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 C9H10I2NO3:   D056+   Pages Related to Peak C9H7I2O3:   D056+   Pages Related to Peak C8H8I2NO:   D056+   Pages Related to Peak C9H7IO3:   D056+   Pages Related to Peak C8H8INO:   D056+   Pages Related to Peak C7H7IO:   D056+   Pages Related to Peak C8H8NO:   D056+  I050+  M127+  P053+  P113+  H050+  M167+  N028+  S058+   Pages Related to Peak C8H7NO:   D056+   Pages Related to Peak C7H7O:   C063+  D046+  D056+  E033+  I050+  P059+  T002+  A137+  D185+  E007+  M167+  M169+  N028+  P070+  S058+  T032+  T033+  T041+  T126+  V021+

Annotations

Precursor	Product	Comments
C8H8I2NO (388)	C8H8INO (261)	IT
C8H8INO (261)	C7H7IO (234)	IT
C8H8INO (261)	C8H8NO (134)	IT
C8H8INO (261)	C8H7NO (133)	IT

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。

KOX00199p	434 C9H10I2NO3	417 C9H7I2O3	388 C8H8I2NO	375 C7H5I2O2	290 C9H7IO3	261 C8H8INO	234 C7H7IO	220 C6H5IO	134 C8H8NO	133 C8H7NO	107 C7H7O
434 C9H10I2NO3
417 C9H7I2O3	H3N
388 C8H8I2NO	CH2O2
375 C7H5I2O2	C2H5NO	C2H2O
290 C9H7IO3	H3IN	I
261 C8H8INO	CH2IO2		I
234 C7H7IO	C2H3INO2	C2IO2	CHIN		C2O2	CHN
220 C6H5IO	C3H5INO2	C3H2IO2	C2H3IN	CIO	C3H2O2	C2H3N	CH2
134 C8H8NO	CH2I2O2		I2			I
133 C8H7NO	CH3I2O2		HI2			HI			H
107 C7H7O	C2H3I2NO2	C2I2O2	CHI2N		C2IO2	CHIN	I		CHN	CN

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

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