| Properties | Image |
|---|
| MNX_ID | MNXM1363937 |
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| reference | biggM:2omhmbl |
| formula | C48H74O4 |
| global charge | 0 |
| mol weight | 715.116 |
| InChIKey | QURLIMHPCRKMJP-UHFFFAOYSA-N |
| InChI | InChI=1S/C48H74O4/c1-35(2)19-12-20-36(3)21-13-22-37(4)23-14-24-38(5)25-15-26-39(6)27-16-28-40(7)29-17-30-41(8)31-18-32-42(9)33-34-44-43(10)45(49)47(51)48(52-11)46(44)50/h19,21,23,25,27,29,31,33,49-51H,12-18,20,22,24,26,28,30,32,34H2,1-11H3 |
| SMILES | COC1=C(O)C(O)=C(C)C(CC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)C)=C1O |
MNX internals
| InChI (mnx) | InChI=1/C48H74O4/c1-35(2)19-12-20-36(3)21-13-22-37(4)23-14-24-38(5)25-15-26-39(6)27-16-28-40(7)29-17-30-41(8)31-18-32-42(9)33-34-44-43(10)45(49)47(51)48(52-11)46(44)50/h19,21,23,25,27,29,31,33,49-51H,12-18,20,22,24,26,28,30,32,34H2,1-11H3/b36-21?,37-23?,38-25?,39-27?,40-29?,41-31?,42-33? |
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| SMILES (mnx) | [CH3:1][C:35]([CH3:2])=[CH:19][CH2:12][CH2:20][C:36]([CH3:3])=[CH:21][CH2:13][CH2:22][C:37]([CH3:4])=[CH:23][CH2:14][CH2:24][C:38]([CH3:5])=[CH:25][CH2:15][CH2:26][C:39]([CH3:6])=[CH:27][CH2:16][CH2:28][C:40]([CH3:7])=[CH:29][CH2:17][CH2:30][C:41]([CH3:8])=[CH:31][CH2:18][CH2:32][C:42]([CH3:9])=[CH:33][CH2:34][C:44]1=[C:43]([CH3:10])[C:45]([OH:49])=[C:47]([OH:51])[C:48]([O:52][CH3:11])=[C:46]1[OH:50] |
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