14-CHLOROCARUBICIN

CAS No.
126722-64-3
CCD No.
CCD00244925
Formula
C26 H26 Cl N O10
MolWeight
547.941

Basic Information

Product Name: 14-CHLOROCARUBICIN
CAS: 126722-64-3
English Synonyms: 14-CHLOROCARUBICIN
MDL Number.: MFCD01713142
H bond acceptor: 11
H bond donor: 6
Smile: C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](Cc3c2c(c4c(c3O)C(=O)c5cccc(c5C4=O)O)O)(C(=O)CCl)O)N)O
InChi: InChI=1S/C26H26ClNO10/c1-9-21(31)12(28)5-16(37-9)38-14-7-26(36,15(30)8-27)6-11-18(14)25(35)20-19(23(11)33)22(32)10-3-2-4-13(29)17(10)24(20)34/h2-4,9,12,14,16,21,29,31,33,35-36H,5-8,28H2,1H3/t9-,12-,14-,16-,21+,26-/m0/s1
InChiKey: InChIKey=ITKOEDSXQQIBIK-CQSLTQQZSA-N

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