| SpectraBase Spectrum ID |
6CmziBuuGWc |
| Name |
(3S,4R,5R,6S)-N-Benzyl-3,6-dioxybenzoyl-4,5-dihydroxyazepane |
| Alternate Name(s) |
(3S,4R,5R,6S)-N-Benzyl-3,6-dibenzoyl-4,5-dihydroxyazepane
(3S,4S,5S,6S)-6-(benzoyloxy)-1-benzyl-4,5-dihydroxyhexahydro-1H-azepin-3-yl benzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H27NO6 |
| InChI |
InChI=1S/C27H27NO6/c29-24-22(33-26(31)20-12-6-2-7-13-20)17-28(16-19-10-4-1-5-11-19)18-23(25(24)30)34-27(32)21-14-8-3-9-15-21/h1-15,22-25,29-30H,16-18H2/t22-,23-,24+,25+/m0/s1 |
| InChIKey |
HVGOUAVYPUNAEY-CXSMSNRLSA-N |
| Molecular Weight |
461.514 g/mol |
| SMILES |
O[C@]1([C@@]([C@](CN(C[C@@]1(OC(=O)c1ccccc1)[H])Cc1ccccc1)(OC(=O)c1ccccc1)[H])(O)[H])[H] |
| SPLASH |
splash10-052f-9500000000-6fa245a97aad8c501903 |
| Source of Spectrum |
Y1-36-223-5 |
| Wiley ID |
1526984 |
