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经验公式(希尔记法):
C31H34N2O5S
化学文摘社编号:
分子量:
546.68
NACRES:
NA.03
PubChem Substance ID:
UNSPSC Code:
12352200
MDL number:
Beilstein/REAXYS Number:
7673243
Quality Segment
assay
>95%, 98% (HPLC)
contains
≤3% Pyridine as stabilizer
SMILES string
COc1ccc(cc1)C(N2C3CS[C@@H](CCCCC(O)=O)C3NC2=O)(c4ccccc4)c5ccc(OC)cc5
InChI
1S/C31H34N2O5S/c1-37-24-16-12-22(13-17-24)31(21-8-4-3-5-9-21,23-14-18-25(38-2)19-15-23)33-26-20-39-27(29(26)32-30(33)36)10-6-7-11-28(34)35/h3-5,8-9,12-19,26-27,29H,6-7,10-11,20H2,1-2H3,(H,32,36)(H,34,35)/t26-,27-,29-/m0/s1
InChI key
RMWVJZXKPGLZEJ-YCVJPRETSA-N
存储类别
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Faceshields, Gloves, Goggles