Molecular Structure:
CCD No.:CCD00561404
GIMATECAN
CAS No.:
292618-32-7
Formula:C25 H25 N3 O5
MolWeight:447.488
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| Product Name： | GIMATECAN |
| CAS： | 292618-32-7 |
| English Synonyms： | GIMATECAN |
| MDL Number.： | MFCD06795143 |
| H bond acceptor： | 8 |
| H bond donor： | 1 |
| Smile： | CC[C@@]1(c2cc-3n(c(=O)c2COC1=O)Cc4c3nc5ccccc5c4/C=N/OC(C)(C)C)O |
| InChi： | InChI=1S/C25H25N3O5/c1-5-25(31)18-10-20-21-16(12-28(20)22(29)17(18)13-32-23(25)30)15(11-26-33-24(2,3)4)14-8-6-7-9-19(14)27-21/h6-11,31H,5,12-13H2,1-4H3/b26-11+/t25-/m0/s1 |
| InChiKey： | InChIKey=UIVFUQKYVFCEKJ-OPTOVBNMSA-N |
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