| Properties | Image |
|---|
| MNX_ID | MNXM48225 |
 |
| reference | chebi:4029 |
| formula | C27H48N2 |
| global charge | 0 |
| mol weight | 400.695 |
| InChIKey | PLKVWYPBRRRIQG-QGSMACLHSA-N |
| InChI | InChI=1S/C27H48N2/c1-18(29(7)8)19-11-13-25(5)21-10-9-20-23(2,3)22(28-6)12-14-26(20)17-27(21,26)16-15-24(19,25)4/h18-22,28H,9-17H2,1-8H3/t18-,19+,20-,21-,22-,24+,25-,26+,27-/m0/s1 |
| SMILES | CN[C@H]1CC[C@]23C[C@]24CC[C@]2(C)[C@@H]([C@H](C)N(C)C)CC[C@@]2(C)[C@@H]4CC[C@H]3C1(C)C |
MNX internals
| InChI (mnx) | InChI=1/C27H48N2/c1-18(29(7)8)19-11-13-25(5)21-10-9-20-23(2,3)22(28-6)12-14-26(20)17-27(21,26)16-15-24(19,25)4/h18-22,28H,9-17H2,1-8H3/t18-,19+,20-,21-,22-,24+,25-,26+,27-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][C@@H:18]([C@H:19]1[CH2:11][CH2:13][C@@:25]2([CH3:5])[C@@H:21]3[CH2:10][CH2:9][C@H:20]4[C:23]([CH3:2])([CH3:3])[C@@H:22]([NH:28][CH3:6])[CH2:12][CH2:14][C@@:26]45[CH2:17][C@@:27]35[CH2:16][CH2:15][C@:24]12[CH3:4])[N:29]([CH3:7])[CH3:8] |
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