Molecular Structure:
CCD No.:CCD00096953
ISOCEMBROL
CAS No.:
20489-82-1
Formula:C20 H34 O
MolWeight:290.488
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| Product Name： | ISOCEMBROL |
| CAS： | 20489-82-1 |
| English Synonyms： | ISOCEMBROL ; THUNBERGOL |
| MDL Number.： | MFCD00210517 |
| H bond acceptor： | 1 |
| H bond donor： | 1 |
| Smile： | C/C/1=C/CC[C@@](/C=C/[C@@H](CC/C(=C/CC1)/C)C(C)C)(C)O |
| InChi： | InChI=1S/C20H34O/c1-16(2)19-12-11-18(4)9-6-8-17(3)10-7-14-20(5,21)15-13-19/h9-10,13,15-16,19,21H,6-8,11-12,14H2,1-5H3/b15-13+,17-10-,18-9+/t19-,20-/m1/s1 |
| InChiKey： | InChIKey=YAPXSYXFLHDPCK-RJTGTAKJSA-N |
Basic Information
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