| Properties | Image |
MNX_ID | MNXM744069 |
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reference | metacycM:VLC-Alpha-hydroxyphytoceramides |
formula | C41H81NO5*2 |
global charge | 0 |
mol weight | |
InChIKey | |
InChI | |
SMILES | [*]CCCCCCCCCCCCCCCCCCCCC[C@H](O)C(=O)N[C@@H](CO)[C@H](O)[C@H](O)CCCCCCCCCCCCCC[*] |
MNX internals
InChI (mnx) | InChI=1/C43H87NO5/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-35-37-41(47)43(49)44-39(38-45)42(48)40(46)36-34-32-30-28-26-24-16-14-12-10-8-6-4-2/h39-42,45-48H,3-38H2,1-2H3,(H,44,49)/t39-,40+,41-,42-/m0/s1/i1+1,2+1 |
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SMILES (mnx) | [13CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:25][CH2:27][CH2:29][CH2:31][CH2:33][CH2:35][CH2:37][C@@H:41]([C:43](=[N:44][C@@H:39]([CH2:38][OH:45])[C@@H:42]([C@@H:40]([CH2:36][CH2:34][CH2:32][CH2:30][CH2:28][CH2:26][CH2:24][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][13CH3:2])[OH:46])[OH:48])[OH:49])[OH:47] |
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