SHIKIMIC ACID ,138-59-0 _Chemical Cloud Database

SHIKIMIC ACID

Basic Information
Product Name：	SHIKIMIC ACID
CAS：	138-59-0
English Synonyms：	BRACKEN FERN TOXIC COMPONENT ; (3R,4S,5R)-(-)-3,4,5-TRIHYDROXY-1-CYCLOHEXENECARBOXYLIC ACID ; (3R,4S,5R)-3,4,5-TRIHYDROXY-CYCLOHEX-1-ENECARBOXYLIC ACID ; L-SHIKIMIC ACID ; [3R-(3-A-,4-A,5-BETA)]-3,4,5-TRIHYDROXY-1-CYCLOHEXENE-1-CARBOXYLIC ACID ; (3R,4S,5R)-3,4,5-TRIHYDROXYL-1-CYCLOHEXENE-1-CARBOXYLIC ACID ; (-)-SHIKIMIC ACID ; (3R,4S,5R)-(-)-3,4,5-TRIHYDROXY-1-CYCLOHEXENE-1-CARBOXYLIC ACID ; SHIKIMIC ACID ; (3R,4S,5R)-3,4,5-TRIHYDROXY-1-CYCLOHEXENECARBOXYLIC ACID ; (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-1-ENE-1-CARBOXYLIC ACID ; SHIKIMATE ; 3,4,5-TRIHYDROXY-1-CYCLOHEXENE-1-CARBOXYLIC ACID ; L-(-)-SHIKIMIC ACID ; (3R,4S,5R)-3,4,5-TRIHYDROXY-1-CYCLOHEXENE-1-CARBOXYLIC ACID
MDL Number.：	MFCD00066278
H bond acceptor：	5
H bond donor：	4
Smile：	C1[C@H]([C@@H]([C@@H](C=C1C(=O)O)O)O)O
InChi：	InChI=1S/C7H10O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1,4-6,8-10H,2H2,(H,11,12)/t4-,5-,6-/m1/s1
InChiKey：	InChIKey=JXOHGGNKMLTUBP-HSUXUTPPSA-N
Property
Melting Point：	185-187 DEG C(LIT)/185-187 °C
Comments：	ASSAY METHOD: T OPTICAL ACTIVITY: [ALPHA]/D -180.0+/-5.0 DEG, C = 4 IN H2O RTECS: GW4600000 SHELF LIFE: LIMITED SHELF LIFE, EXPIRY DATE ON THE LABEL STORAGE TEMPERATURE: 2-8 DEG C WGK: 3
Specification：	ANALYTICAL STANDARD
Safety information
Safe Code：	S:S24/25;
WGK Germany：	3

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