SpectraBase Compound ID | BNSWrzmT3GZ |
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InChI | InChI=1S/C18H27NO5/c1-4-12-9-11(2)18(3,22)17(21)23-10-13-5-7-19-8-6-14(15(13)19)24-16(12)20/h4,11,13-15,22H,5-10H2,1-3H3/b12-4+/t11?,13-,14+,15?,18?/m0/s1 |
InChIKey | BTHCJHQOYFUIMG-YYDUWEFXSA-N |
Mol Weight | 337.42 g/mol |
Molecular Formula | C18H27NO5 |
Exact Mass | 337.188923 g/mol |
SpectraBase Spectrum ID | JclxyHwI3bI |
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Name | Neoplatyphylline |
CAS Registry Number | 20361-77-7 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C18H27NO5 |
InChI | InChI=1S/C18H27NO5/c1-4-12-9-11(2)18(3,22)17(21)23-10-13-5-7-19-8-6-14(15(13)19)24-16(12)20/h4,11,13-15,22H,5-10H2,1-3H3/b12-4+/t11?,13-,14+,15?,18?/m0/s1 |
InChIKey | BTHCJHQOYFUIMG-YYDUWEFXSA-N |
Molecular Weight | 337.416 g/mol |
SMILES | OC1(C(C\C(C(O[C@]2(C3N(CC[C@]3(COC1=O)[H])CC2)[H])=O)=C/C)C)C |
SPLASH | splash10-00el-4920000000-7d5a39f3e9bfe1fba132 |
Source of Spectrum | CD-191-0-0 |
Synonyms | Hastacine |
Wiley ID | 1333076 |