| Properties | Image |
|---|
| MNX_ID | MNXM1106790 |
 |
| reference | metacycM:Archeal-Dolichol-P |
| formula | C55H93O4P |
| global charge | -2 |
| mol weight | 849.319 |
| InChIKey | KTGSDHZXAKCYHM-LSTWDCEHSA-L |
| InChI | InChI=1S/C55H95O4P/c1-45(2)23-13-24-46(3)25-14-26-47(4)27-15-28-48(5)29-16-30-49(6)31-17-32-50(7)33-18-34-51(8)35-19-36-52(9)37-20-38-53(10)39-21-40-54(11)41-22-42-55(12)43-44-59-60(56,57)58/h25,27,29,31,33,35,37,39,41,45,55H,13-24,26,28,30,32,34,36,38,40,42-44H2,1-12H3,(H2,56,57,58)/p-2/b46-25+,47-27+,48-29-,49-31-,50-33-,51-35-,52-37-,53-39-,54-41- |
| SMILES | C/C(=C/CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CCC(C)CCOP(=O)([O-])[O-])CC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(\C)CC/C=C(\C)CCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C55H95O4P/c1-45(2)23-13-24-46(3)25-14-26-47(4)27-15-28-48(5)29-16-30-49(6)31-17-32-50(7)33-18-34-51(8)35-19-36-52(9)37-20-38-53(10)39-21-40-54(11)41-22-42-55(12)43-44-59-60(56,57)58/h25,27,29,31,33,35,37,39,41,45,55H,13-24,26,28,30,32,34,36,38,40,42-44H2,1-12H3,(H2,56,57,58)/b46-25+,47-27+,48-29-,49-31-,50-33-,51-35-,52-37-,53-39-,54-41-/t55? |
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| SMILES (mnx) | [CH3:1][CH:45]([CH3:2])[CH2:23][CH2:13][CH2:24]/[C:46]([CH3:3])=[CH:25]/[CH2:14][CH2:26]/[C:47]([CH3:4])=[CH:27]/[CH2:15][CH2:28]/[C:48]([CH3:5])=[CH:29]\[CH2:16][CH2:30]/[C:49]([CH3:6])=[CH:31]\[CH2:17][CH2:32]/[C:50]([CH3:7])=[CH:33]\[CH2:18][CH2:34]/[C:51]([CH3:8])=[CH:35]\[CH2:19][CH2:36]/[C:52]([CH3:9])=[CH:37]\[CH2:20][CH2:38]/[C:53]([CH3:10])=[CH:39]\[CH2:21][CH2:40]/[C:54]([CH3:11])=[CH:41]\[CH2:22][CH2:42][CH:55]([CH3:12])[CH2:43][CH2:44][O:59][P:60]([OH:56])([OH:57])=[O:58] |
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