| Properties | Image |
|---|
| MNX_ID | MNXM168306 |
 |
| reference | sabiorkM:29149 |
| formula | C34H44N4O4 |
| global charge | 0 |
| mol weight | 572.75 |
| InChIKey | XUHCJAPDIYIBNN-UHFFFAOYSA-N |
| InChI | InChI=1S/C34H44N4O4/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)35-25/h35-38H,7-16H2,1-6H3,(H,39,40)(H,41,42) |
| SMILES | CCC1=C2CC3=C(C)C(CC)=C(CC4=C(C)C(CCC(=O)O)=C(CC5=C(CCC(=O)O)C(C)=C(CC(=C1C)N2)N5)N4)N3 |
MNX internals
| InChI (mnx) | InChI=1/C34H44N4O4/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)35-25/h35-38H,7-16H2,1-6H3,(H,39,40)(H,41,42) |
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| SMILES (mnx) | [CH3:1][CH2:7][C:21]1=[C:29]2[CH2:14][C:27]3=[C:18]([CH3:4])[C:22]([CH2:8][CH3:2])=[C:30]([CH2:15][C:28]4=[C:20]([CH3:6])[C:24]([CH2:10][CH2:12][C:34](=[O:41])[OH:42])=[C:32]([CH2:16][C:31]5=[C:23]([CH2:9][CH2:11][C:33](=[O:39])[OH:40])[C:19]([CH3:5])=[C:26]([CH2:13][C:25](=[C:17]1[CH3:3])[NH:35]2)[NH:37]5)[NH:38]4)[NH:36]3 |
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