| Properties | Image |
|---|
| MNX_ID | MNXM741041 |
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| reference | biggM:uLa4fn |
| formula | C61H99NO8P |
| global charge | -1 |
| mol weight | 1005.436 |
| InChIKey | YYVYMEXYAGAGTM-UHFFFAOYSA-M |
| InChI | InChI=1S/C61H100NO8P/c1-47(2)23-13-24-48(3)25-14-26-49(4)27-15-28-50(5)29-16-30-51(6)31-17-32-52(7)33-18-34-53(8)35-19-36-54(9)37-20-38-55(10)39-21-40-56(11)41-22-42-57(12)43-44-69-71(66,67)70-60-58(64)59(65)61(62,45-63)46-68-60/h23,25,27,29,31,33,35,37,39,41,43,45,58-60,64-65H,13-22,24,26,28,30,32,34,36,38,40,42,44,46,62H2,1-12H3,(H,66,67)/p-1 |
| SMILES | CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCOP(=O)([O-])OC1OCC(N)(C=O)C(O)C1O |
MNX internals
| InChI (mnx) | InChI=1/C61H100NO8P/c1-47(2)23-13-24-48(3)25-14-26-49(4)27-15-28-50(5)29-16-30-51(6)31-17-32-52(7)33-18-34-53(8)35-19-36-54(9)37-20-38-55(10)39-21-40-56(11)41-22-42-57(12)43-44-69-71(66,67)70-60-58(64)59(65)61(62,45-63)46-68-60/h23,25,27,29,31,33,35,37,39,41,43,45,58-60,64-65H,13-22,24,26,28,30,32,34,36,38,40,42,44,46,62H2,1-12H3,(H,66,67)/b48-25?,49-27?,50-29?,51-31?,52-33?,53-35?,54-37?,55-39?,56-41?,57-43?/t58?,59?,60?,61? |
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| SMILES (mnx) | [CH3:1][C:47]([CH3:2])=[CH:23][CH2:13][CH2:24][C:48]([CH3:3])=[CH:25][CH2:14][CH2:26][C:49]([CH3:4])=[CH:27][CH2:15][CH2:28][C:50]([CH3:5])=[CH:29][CH2:16][CH2:30][C:51]([CH3:6])=[CH:31][CH2:17][CH2:32][C:52]([CH3:7])=[CH:33][CH2:18][CH2:34][C:53]([CH3:8])=[CH:35][CH2:19][CH2:36][C:54]([CH3:9])=[CH:37][CH2:20][CH2:38][C:55]([CH3:10])=[CH:39][CH2:21][CH2:40][C:56]([CH3:11])=[CH:41][CH2:22][CH2:42][C:57]([CH3:12])=[CH:43][CH2:44][O:69][P:71]([OH:66])(=[O:67])[O:70][CH:60]1[CH:58]([OH:64])[CH:59]([OH:65])[C:61]([CH:45]=[O:63])([NH2:62])[CH2:46][O:68]1 |
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