| Properties | Image |
|---|
| MNX_ID | MNXM102072 |
 |
| reference | chebi:65771 |
| formula | C36H54N2O6 |
| global charge | 0 |
| mol weight | 610.836 |
| InChIKey | VONRPUZNFPTEEM-RVDMUPIBSA-N |
| InChI | InChI=1S/C36H54N2O6/c1-25(2)15-11-7-9-13-17-33(39)37-23-27-19-29(35(41)31(21-27)43-5)30-20-28(22-32(44-6)36(30)42)24-38-34(40)18-14-10-8-12-16-26(3)4/h11,15,19-22,25-26,41-42H,7-10,12-14,16-18,23-24H2,1-6H3,(H,37,39)(H,38,40)/b15-11+ |
| SMILES | COC1=CC(CNC(=O)CCCC/C=C/C(C)C)=CC(C2=C(O)C(OC)=CC(CNC(=O)CCCCCCC(C)C)=C2)=C1O |
MNX internals
| InChI (mnx) | InChI=1/C36H54N2O6/c1-25(2)15-11-7-9-13-17-33(39)37-23-27-19-29(35(41)31(21-27)43-5)30-20-28(22-32(44-6)36(30)42)24-38-34(40)18-14-10-8-12-16-26(3)4/h11,15,19-22,25-26,41-42H,7-10,12-14,16-18,23-24H2,1-6H3,(H,37,39)(H,38,40)/b15-11+ |
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| SMILES (mnx) | [CH3:1][CH:25]([CH3:2])/[CH:15]=[CH:11]/[CH2:7][CH2:9][CH2:13][CH2:17][C:33](=[N:37][CH2:23][C:27]1=[CH:19][C:29]([C:30]2=[C:36]([OH:42])[C:32]([O:44][CH3:6])=[CH:22][C:28]([CH2:24][N:38]=[C:34]([CH2:18][CH2:14][CH2:10][CH2:8][CH2:12][CH2:16][CH:26]([CH3:3])[CH3:4])[OH:40])=[CH:20]2)=[C:35]([OH:41])[C:31]([O:43][CH3:5])=[CH:21]1)[OH:39] |
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