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About This Item
Empirical Formula (Hill Notation):
C22H23ClN2O8 · HCl
CAS Number:
Molecular Weight:
515.34
EC Number:
200-591-7
UNSPSC Code:
12352103
MDL number:
Beilstein/REAXYS Number:
3858364
assay
80%
optical activity
[α]25/D −232°, c = 1 in H2O
SMILES string
Cl.CN(C)[C@H]1[C@@H]2CC3C(=C(O)[C@]2(O)C(=O)C(C(N)=O)=C1O)C(=O)c4c(O)ccc(Cl)c4[C@@]3(C)O
InChI
1S/C22H23ClN2O8.ClH/c1-21(32)7-6-8-15(25(2)3)17(28)13(20(24)31)19(30)22(8,33)18(29)11(7)16(27)12-10(26)5-4-9(23)14(12)21;/h4-5,7-8,15,26,28-29,32-33H,6H2,1-3H3,(H2,24,31);1H/t7?,8-,15-,21-,22-;/m0./s1
InChI key
CBHYYLPALVVVEY-LYNLVHCPSA-N
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Other Notes
remainder mainly tetracycline hydrochloride
Regulatory Information
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