| Properties | Image |
|---|
| MNX_ID | MNXM158600 |
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| reference | chebi:74204 |
| formula | C42H85NO4 |
| global charge | 0 |
| mol weight | 668.145 |
| InChIKey | MQRJKPCPZDICLU-LFVSMIGWSA-N |
| InChI | InChI=1S/C42H85NO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-27-30-33-36-41(46)43-39(37-44)42(47)40(45)35-32-29-26-24-23-25-28-31-34-38(2)3/h38-40,42,44-45,47H,4-37H2,1-3H3,(H,43,46)/t39-,40+,42-/m0/s1 |
| SMILES | CCCCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO)[C@H](O)[C@H](O)CCCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C42H85NO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-27-30-33-36-41(46)43-39(37-44)42(47)40(45)35-32-29-26-24-23-25-28-31-34-38(2)3/h38-40,42,44-45,47H,4-37H2,1-3H3,(H,43,46)/t39-,40+,42-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:27][CH2:30][CH2:33][CH2:36][C:41](=[N:43][C@@H:39]([CH2:37][OH:44])[C@@H:42]([C@@H:40]([CH2:35][CH2:32][CH2:29][CH2:26][CH2:24][CH2:23][CH2:25][CH2:28][CH2:31][CH2:34][CH:38]([CH3:2])[CH3:3])[OH:45])[OH:47])[OH:46] |
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