DOMOIC ACID ,14277-97-5 _Chemical Cloud Database

DOMOIC ACID

Basic Information
Product Name：	DOMOIC ACID
CAS：	14277-97-5
English Synonyms：	2S-[2ALPHA, 3BETA, 4BETA (1Z, 3E, 5R)]-2-CARBOXY-4-(5-CARBOXY-1-METHYL-1,3-HEXADIENYL)-3-PYRROLIDINEACETIC ACID ; CRM-DA-E ; RM-ASP-MUS ; (2S,3S,4S)-3-(CARBOXYMETHYL)-4-[(2Z,4E,6R)-7-HYDROXY-6-METHYL-7-OXOHEPTA-2,4-DIEN-2-YL]PYRROLIDINE-2-CARBOXYLIC ACID ; CRM-ASP-MUS-C ; DOMOIC ACID
MDL Number.：	MFCD06795841
H bond acceptor：	7
H bond donor：	4
Smile：	C[C@H](/C=C/C=C(/C)\[C@H]1CN[C@@H]([C@H]1CC(=O)O)C(=O)O)C(=O)O
InChi：	InChI=1S/C15H21NO6/c1-8(4-3-5-9(2)14(19)20)11-7-16-13(15(21)22)10(11)6-12(17)18/h3-5,9-11,13,16H,6-7H2,1-2H3,(H,17,18)(H,19,20)(H,21,22)/b5-3+,8-4-/t9-,10+,11-,13+/m1/s1
InChiKey：	InChIKey=VZFRNCSOCOPNDB-AOKDLOFSSA-N
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