Search Result : Detailed Informations

Low Mol Weight Allergen Name	CAS#	CID
Pelargonidin chloride	134-04-3	67249

Structure

Other Information

Canonical SMILES	C1=CC(=CC=C1C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)O)O.[Cl-]
Iso SMILES	C1=CC(=CC=C1C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)O)O.[Cl-]
InChI	InChI=1S/C15H10O5.ClH/c16-9-3-1-8(2-4-9)15-13(19)7-11-12(18)5-10(17)6-14(11)20-15;/h1-7H,(H3-,16,17,18,19);1H
InChI Key	YPVZJXMTXCOTJN-UHFFFAOYSA-N
Formula	C15H11ClO5
Mol Weight	306.698
XlogP3	0
Charge	0

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Synonyms Information

CAS Name	2-(4-hydroxyphenyl)-1-benzopyrylium-3,5,7-triol chloride
IUPAC Name	2-(4-hydroxyphenyl)chromenylium-3,5,7-triol chloride
Openeye Name	2-(4-hydroxyphenyl)chromenylium-3,5,7-triol chloride
Systematic Name	2-(4-hydroxyphenyl)chromenylium-3,5,7-triol chloride
Tratitional Name	2-(4-hydroxyphenyl)chromenylium-3,5,7-triol chloride