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About This Item
Empirical Formula (Hill Notation):
C21H24N4O4
CAS Number:
Molecular Weight:
396.44
PubChem Substance ID:
UNSPSC Code:
12352200
Beilstein/REAXYS Number:
4828015
MDL number:
assay
97%
optical activity
[α]20/D +8°, c = 1 in DMF
impurities
<3% water
mp
145-150 °C (lit.)
SMILES string
NC(=N)NCCC[C@H](NC(=O)OCC1c2ccccc2-c3ccccc13)C(O)=O
InChI
1S/C21H24N4O4/c22-20(23)24-11-5-10-18(19(26)27)25-21(28)29-12-17-15-8-3-1-6-13(15)14-7-2-4-9-16(14)17/h1-4,6-9,17-18H,5,10-12H2,(H,25,28)(H,26,27)(H4,22,23,24)/t18-/m0/s1
InChI key
DVBUCBXGDWWXNY-SFHVURJKSA-N
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