BIXIN

Investigational

Details

Stereochemistry	ACHIRAL
Molecular Formula	C25H30O4
Molecular Weight	394.5033
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	9
Charge	0

SHOW SMILES / InChI

SMILES

COC(=O)\C=C\C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C(O)=O

InChI

InChIKey=RAFGELQLHMBRHD-SLEZCNMESA-N

InChI=1S/C25H30O4/c1-20(12-8-14-22(3)16-18-24(26)27)10-6-7-11-21(2)13-9-15-23(4)17-19-25(28)29-5/h6-19H,1-5H3,(H,26,27)/b7-6+,12-8+,13-9+,18-16+,19-17+,20-10+,21-11+,22-14+,23-15-

HIDE SMILES / InChI

Approval Year

PubMed

Show entries

Title	Date	PubMed
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.	2006 Nov	16497524

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Patents

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Name

Type

Language

BIXIN

Common Name

English

ANNATTO (E 160B)

Common Name

English

2,4,6,8,10,12,14,16,18-EICOSANONAENEDIOIC ACID, 4,8,13,17-TETRAMETHYL-, 1-METHYL ESTER, (2E,4Z,6E,8E,10E,12E,14E,16E,18E)-

Systematic Name

English

BIXINS CIS-FORM

Common Name

English

BIXIN [MART.]

Common Name

English

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Code System

Code

Type

Description

MERCK INDEX

m2582

PRIMARY

Merck Index

ECHA (EC/EINECS)

230-248-7

PRIMARY

EVMPD

SUB177139

PRIMARY

EPA CompTox

DTXSID1024629

PRIMARY

CHEBI

3136

PRIMARY

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SUBSTANCE RECORD


					9L7T4VB66G

BIXIN