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About This Item
Empirical Formula (Hill Notation):
13CC20D3H23N2O3
CAS Number:
Molecular Weight:
358.45
NACRES:
NA.24
PubChem Substance ID:
UNSPSC Code:
12352108
MDL number:
Isotopic purity:
13C, D, ≥99 atom %
Assay:
≥98% (CP)
Mass shift:
M+4
Form:
solid
Quality Level
isotopic purity
13C, D, ≥99 atom %
assay
≥98% (CP)
form
solid
technique(s)
mass spectrometry (MS): suitable
mp
288-290 °C (dec) (lit.)
mass shift
M+4
storage temp.
−20°C
SMILES string
[2H][13C]([2H])([2H])OC(=O)[C@H]1[C@@H](O)CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12
InChI
1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15-,17-,18-,19+/m0/s1/i1+1D3
InChI key
BLGXFZZNTVWLAY-BRIZNRDQSA-N
Packaging
This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.
signalword
Danger
hcodes
Hazard Classifications
Acute Tox. 3 Dermal - Acute Tox. 3 Inhalation - Acute Tox. 3 Oral
Storage Class
6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
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Danuše Tarkowská
Molecules (Basel, Switzerland), 25(14) (2020-07-28)
Many substances of secondary plant metabolism have often attracted the attention of scientists and the public because they have certain beneficial effects on human health, although the reason for their biosynthesis in the plant remains unclear. This is also the
Global Trade Item Number
| SKU | GTIN |
|---|---|
| 731242-5MG | 04061833240274 |
| 731242-10MG | 04061833258927 |
