00010
Abietic acid
technical, ~75% (GC)
동의어(들):
7,13-abietadien-18-oic acid, Abietate, L-Abietic acid, Rosin acid, Sylvic acid, sylvic acid
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크기 선택
보기 변경
제품정보 (DICE 배송 시 비용 별도)
실험식(Hill 표기법):
C20H30O2
CAS 번호:
Molecular Weight:
302.45
NACRES:
NA.22
PubChem Substance ID:
eCl@ss:
32150233
UNSPSC Code:
12352002
EC Number:
208-178-3
MDL number:
Beilstein/REAXYS Number:
2221451
Assay:
~75% (GC)
Form:
solid
grade
technical
Quality Level
assay
~75% (GC)
form
solid
optical activity
[α]20/D −85±10°, c = 1% in ethanol
mp
139-142 °C (lit.), 150-165 °C
functional group
carboxylic acid
storage temp.
2-8°C
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)
Application
Abietic acid can be used as a precursor in the preparation of:
It can also be used as a starting material in the total synthesis of:
- Epoxy and petrochemical curing agents.
- Dehydroabietic acid derivatives as potential antitumor, antimycotic, and antiviral agents.
It can also be used as a starting material in the total synthesis of:
- (−)-triptonide and (−)-triptolide as potent antitumor and immunosuppressant agents
- quinone (−)-12-deoxyroyleanone as antileishmanial agent
- abietic acid-derived catechol (methyl 11,12-dihydroxyabietate-8,11,13-trien-18-oate, MDTO) as a potential antioxidant agent
Other Notes
Starting material for natural product synthesis; Epoxidation with MCPBA
signalword
Warning
hcodes
Hazard Classifications
Aquatic Acute 1 - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
저장 등급
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
G. Buchbauer et al.
Scientia Pharmaceutica, 53, 173-173 (1985)
Synthesis and biological evaluation of dehydroabietic acid derivatives.
Gonzalez M A, et al.
European Journal of Medicinal Chemistry, 45(2), 811-816 (2010)
S. Valverde et al.
Tetrahedron, 42, 573-573 (1986)