Structure

Carnosic Acid

CAS
3650-09-7
Catalog Number
ACM3650097
Category
Inhibitors
Molecular Weight
332.43
Molecular Formula
C20H28O4

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Specification

Description
Carnosic acid has demonstrated inhibition of oxidative stress and inflammation, suppression of cell proliferation, and antibacterial activity.
Synonyms
Carnosic acid from Rosmarinus officinalis
IUPAC Name
(4aR,10aS)-5,6-dihydroxy-1,1-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-4a-carboxylic acid
Canonical SMILES
CC(C)C1=C(C(=C2C(=C1)CC[C@@H]3[C@@]2(CCCC3(C)C)C(=O)O)O)O
InChI
InChI=1S/C20H28O4/c1-11(2)13-10-12-6-7-14-19(3,4)8-5-9-20(14,18(23)24)15(12)17(22)16(13)21/h10-11,14,21-22H,5-9H2,1-4H3,(H,23,24)/t14-,20+/m0/s1
InChI Key
QRYRORQUOLYVBU-VBKZILBWSA-N
Boiling Point
506.4±50.0 °C
Melting Point
190 °C (lit.)
Density
1.184±0.06 g/ml
Appearance
Yellow powder
Storage
-80°C, stored under nitrogen
Exact Mass
332.19875937
Isomeric SMILES
CC(C)C1=C(C(=C2C(=C1)CC[C@@H]3[C@@]2(CCCC3(C)C)C(=O)O)O)O
Monoisotopic Mass
332.19875937
Physical State
Powder
pKa
4.14±0.4
Shipping
Shipping with dry ice.
Source
PlantsCompositaeBrachyclados megalanthus Speg.PlantsLabiatae
Storage Conditions
Inert atmosphere,under -20 °C
Topological Polar Surface Area
77.8 Ų
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