| SpectraBase Spectrum ID |
BHVBV2LjjHw |
| Name |
(1r,5s,6R,9S,10s,11r,12S,15R)-3-[(4-Chlorobenzoyl)amino]-3-azahexacyclo[7.6.0.0(1,5).0(5,12).0(6,10).0(11,15)]pentadecane-2,4-dione) |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H19ClN2O3 |
| InChI |
InChI=1S/C21H19ClN2O3/c22-10-3-1-9(2-4-10)17(25)23-24-18(26)20-11-5-6-12-15(11)16-13(20)7-8-14(16)21(12,20)19(24)27/h1-4,11-16H,5-8H2,(H,23,25)/t11-,12+,13+,14-,15-,16+,20-,21+ |
| InChIKey |
NSBZNTZOANUIPR-VSADEHQJSA-N |
| Literature Reference DOI |
10.1002/cmdc.201000306 |
| Molecular Weight |
382.847 g/mol |
| SMILES |
N(N1C([C@]23[C@@]4(CC[C@]5([C@@]4([C@]4([C@@]3(CC[C@]4([C@@]25C1=O)[H])[H])[H])[H])[H])[H])=O)C(=O)c1ccc(cc1)Cl |
| SPLASH |
splash10-000i-0902000000-d467e1b24c796e0113f6 |
| Source of Spectrum |
CMC-5-2072/SM8-9d |
| Wiley ID |
1771680 |
![(1r,5s,6R,9S,10s,11r,12S,15R)-3-[(4-Chlorobenzoyl)amino]-3-azahexacyclo[7.6.0.0(1,5).0(5,12).0(6,10).0(11,15)]pentadecane-2,4-dione)](/api/spectrum/BHVBV2LjjHw/structure.png?h=300&w=458 "(1r,5s,6R,9S,10s,11r,12S,15R)-3-[(4-Chlorobenzoyl)amino]-3-azahexacyclo[7.6.0.0(1,5).0(5,12).0(6,10).0(11,15)]pentadecane-2,4-dione)")
