| Properties | Image |
|---|
| MNX_ID | MNXM1368769 |
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| reference | biggM:mql8 |
| formula | C51H74O2 |
| global charge | 0 |
| mol weight | 719.151 |
| InChIKey | OIEZRVBFVPGODT-UHFFFAOYSA-N |
| InChI | InChI=1S/C51H74O2/c1-38(2)20-13-21-39(3)22-14-23-40(4)24-15-25-41(5)26-16-27-42(6)28-17-29-43(7)30-18-31-44(8)32-19-33-45(9)36-37-47-46(10)50(52)48-34-11-12-35-49(48)51(47)53/h11-12,20,22,24,26,28,30,32,34-36,52-53H,13-19,21,23,25,27,29,31,33,37H2,1-10H3 |
| SMILES | CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCC1=C(O)C2=C(C=CC=C2)C(O)=C1C |
MNX internals
| InChI (mnx) | InChI=1/C51H74O2/c1-38(2)20-13-21-39(3)22-14-23-40(4)24-15-25-41(5)26-16-27-42(6)28-17-29-43(7)30-18-31-44(8)32-19-33-45(9)36-37-47-46(10)50(52)48-34-11-12-35-49(48)51(47)53/h11-12,20,22,24,26,28,30,32,34-36,52-53H,13-19,21,23,25,27,29,31,33,37H2,1-10H3/b39-22?,40-24?,41-26?,42-28?,43-30?,44-32?,45-36? |
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| SMILES (mnx) | [CH3:1][C:38]([CH3:2])=[CH:20][CH2:13][CH2:21][C:39]([CH3:3])=[CH:22][CH2:14][CH2:23][C:40]([CH3:4])=[CH:24][CH2:15][CH2:25][C:41]([CH3:5])=[CH:26][CH2:16][CH2:27][C:42]([CH3:6])=[CH:28][CH2:17][CH2:29][C:43]([CH3:7])=[CH:30][CH2:18][CH2:31][C:44]([CH3:8])=[CH:32][CH2:19][CH2:33][C:45]([CH3:9])=[CH:36][CH2:37][C:47]1=[C:51]([OH:53])[C:49]2=[CH:35][CH:12]=[CH:11][CH:34]=[C:48]2[C:50]([OH:52])=[C:46]1[CH3:10] |
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