List QUININE BENZOAT…
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CCD No. :
CCD00331795
Product Name : QUININE BENZOATE
CAS No. : 750-88-9
MDL Number. : MFCD02683876
Formula : C27 H28 N2 O4
MolWeight : 444.528
Synonyms :
QUININE BENZOATE;
Mol : QUININE BENZOATE.mol
Product Name : QUININE BENZOATE
CAS No. : 750-88-9
MDL Number. : MFCD02683876
Formula : C27 H28 N2 O4
MolWeight : 444.528
Synonyms :
QUININE BENZOATE;
Mol : QUININE BENZOATE.mol
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| Product Name： | QUININE BENZOATE |
| CAS： | 750-88-9 |
| English Synonyms： | QUININE BENZOATE |
| MDL Number.： | MFCD02683876 |
| H bond acceptor： | 6 |
| H bond donor： | 0 |
| Smile： | COc1ccc2c(c1)c(ccn2)[C@@H]([C@@H]3C[C@@H]4CCN3C[C@@H]4C=C)OC(=O)Oc5ccccc5 |
| InChi： | InChI=1S/C27H28N2O4/c1-3-18-17-29-14-12-19(18)15-25(29)26(33-27(30)32-20-7-5-4-6-8-20)22-11-13-28-24-10-9-21(31-2)16-23(22)24/h3-11,13,16,18-19,25-26H,1,12,14-15,17H2,2H3/t18-,19-,25-,26-/m0/s1 |
| InChiKey： | InChIKey=QYPJZCMPIALCAQ-KBFVSZBXSA-N |
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