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Alloc-DOX

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Category Hepatitis B Virus (HBV)
CAS 561022-65-9
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Product Information

Synonyms Alloc-DOX;EX-A9621G;HY-158329;CS-1052278;561022-65-9;
IUPAC Name prop-2-enyl N-[(2S,3S,4S,6R)-3-hydroxy-2-methyl-6-[[(1S,3S)-3,5,12-trihydroxy-3-(2-hydroxyacetyl)-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]oxan-4-yl]carbamate
Molecular Weight 441.5
Molecular Formula C25H23N5O3
Canonical SMILES CCN1C2=C(C=CC=N2)N(C(=O)C3=C1N=CC(=C3)CCOC4=CC=[N+](C5=CC=CC=C54)[O-])C
InChI InChI=1S/C31H33NO13/c1-4-8-43-30(40)32-16-9-20(44-13(2)25(16)35)45-18-11-31(41,19(34)12-33)10-15-22(18)29(39)24-23(27(15)37)26(36)14-6-5-7-17(42-3)21(14)28(24)38/h4-7,13,16,18,20,25,33,35,37,39,41H,1,8-12H2,2-3H3,(H,32,40)/t13-,16-,18-,20-,25+,31-/m0/s1
InChIKey MYTMRYOJAKUVBH-BPZXBQJLSA-N
Storage Please store the product under the recommended conditions in the Certificate of Analysis.

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