ChemicalBook--->CAS DataBase List--->54113-95-0

54113-95-0

54113-95-0 Structure

54113-95-0 Structure
IdentificationBack Directory
[Name]

15-HYDROXYDEHYDROABIETICACID
[CAS]

54113-95-0
[Synonyms]

15-HYDROXYDEHYDROABIETICACID
15-Hydroxyabieta-8,11,13-trien-18-oicaci
15-Hydroxyabieta-8,11,13-trien-18-oic acid
15-Hydroxy-abieta-8,11,13-triene-18-oic acid
15-Hydroxydehydroabietic acid >=95% (LC/MS-ELSD)
1,4aβ-Dimethyl-7-(1-hydroxy-1-methylethyl)-1,2,3,4,4a,9,10,10aα-octahydrophenanthrene-1α-carboxylic acid
[Molecular Formula]

C20H28O3
[MDL Number]

MFCD17214821
[MOL File]

54113-95-0.mol
[Molecular Weight]

316.435
Chemical PropertiesBack Directory
[storage temp. ]

-20°C
[form ]

solid
[Major Application]

metabolomics
vitamins, nutraceuticals, and natural products
[InChI]

1S/C20H28O3/c1-18(2,23)14-7-8-15-13(12-14)6-9-16-19(15,3)10-5-11-20(16,4)17(21)22/h7-8,12,16,23H,5-6,9-11H2,1-4H3,(H,21,22)/t16-,19-,20-/m1/s1
[InChIKey]

ILQLITDRYFHAGM-NSISKUIASA-N
[SMILES]

CC(C)(O)c1ccc2c(CC[C@H]3[C@@](C)(CCC[C@]23C)C(O)=O)c1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)Environment (GHS09)
GHS07,GHS09
[Signal word ]

Warning
[Hazard statements ]

H302-H410
[Precautionary statements ]

P273-P501
[Hazard Codes ]

Xn,N
[Risk Statements ]

22-50
[Safety Statements ]

61
[RIDADR ]

UN 3077 9 / PGIII
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Aquatic Acute 1
Aquatic Chronic 1
Hazard InformationBack Directory
[Uses]

metabolomics
vitamins, nutraceuticals, and natural products
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