| Properties | Image |
|---|
| MNX_ID | MNXM1369606 |
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| reference | sabiorkM:25151 |
| formula | C36H71NO3 |
| global charge | 0 |
| mol weight | 565.968 |
| InChIKey | VODZWWMEJITOND-OIDHKYIRSA-N |
| InChI | InChI=1S/C36H71NO3/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-36(40)37-34(33-38)35(39)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h29,31,34-35,38-39H,3-28,30,32-33H2,1-2H3,(H,37,40)/t34-,35+/m0/s1 |
| SMILES | CCCCCCCCCCCCCC=C[C@@H](O)[C@H](CO)N=C(O)CCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C36H71NO3/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-36(40)37-34(33-38)35(39)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h29,31,34-35,38-39H,3-28,30,32-33H2,1-2H3,(H,37,40)/b31-29?/t34-,35+/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:18][CH2:20][CH2:22][CH2:24][CH2:26][CH2:28][CH2:30][CH2:32][C:36](=[N:37][C@@H:34]([CH2:33][OH:38])[C@@H:35]([CH:31]=[CH:29][CH2:27][CH2:25][CH2:23][CH2:21][CH2:19][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])[OH:39])[OH:40] |
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