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A9424

Sigma-Aldrich

Abietic acid

≥65% (GC)

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About This Item

Empirical Formula (Hill Notation):
C20H30O2
CAS Number:
514-10-3
Molecular Weight:
302.45
Beilstein/REAXYS Number:
2221451
EC Number:
208-178-3
MDL number:
MFCD03423567
UNSPSC Code:
12352000
PubChem Substance ID:
24891449

concentration

≥65% (GC)

mp

139-142 °C (lit.)

SMILES string

CC(C)C1=CC2=CC[C@@H]3[C@](C)(CCC[C@@]3(C)C(O)=O)[C@H]2CC1

InChI

1S/C20H30O2/c1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22/h7,12-13,16-17H,5-6,8-11H2,1-4H3,(H,21,22)/t16-,17+,19+,20+/m0/s1

InChI key

RSWGJHLUYNHPMX-ONCXSQPRSA-N

Gene Information

human ... TNF(7124)

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Description
Pricing

pictograms

Exclamation markEnvironment
GHS07,GHS09

signalword

Warning

Hazard Classifications

Aquatic Acute 1 - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

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Alan Talevi et al.
Bioorganic & medicinal chemistry letters, 17(6), 1684-1690 (2007-01-20)
Linear discriminant analysis was performed to derive discriminant functions based on 2D descriptors and capable of classifying anticonvulsant from non-anticonvulsant compounds. Through application in virtual screening of the discriminant function which performed best in the validation steps, abietic acid was
Xian-Wen Yang et al.
Bioorganic & medicinal chemistry, 18(2), 744-754 (2009-12-22)
Twenty-five new (abiesadines A-Y, 1-25) and 29 known (26-54) diterpenes were isolated from the aerial parts of Abies georgei. Abiesadine A (1) is a novel 8,14-seco-abietane, while abiesadine B (2) is a novel 9,10-seco-abietane. The structures of the new compounds
Patrick Frank et al.
Analytical chemistry, 84(10), 4419-4428 (2012-05-02)
In 2008 the rostrum from an ancient warship was recovered from the Mediterranean near Acqualadrone, Sicily. To establish its provenance and condition, samples of black and brown rostrum wood were examined using sulfur K-edge X-ray absorption spectroscopy (XAS) and gas
Simon Janocha et al.
Chembiochem : a European journal of chemical biology, 14(4), 467-473 (2013-02-02)
Cytochrome P450s are very versatile enzymes with great potential for biotechnological applications because of their ability to oxidize unactivated CH bonds. CYP105A1 from Streptomyces griseolus was first described as a herbicide-inducible sulfonylurea hydroxylase, but it is also able to convert
Yi He et al.
Journal of pharmaceutical and biomedical analysis, 66, 345-348 (2012-04-10)
An herbal drug for the treatment of psoriasis showed severe clinical adverse reactions. The main component of adulterant was isolated from the drug and its chemical structure was elucidated as abietic acid using NMR, HR-MS, and HPLC-DAD-MS. Although abietic acid
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