| Properties | Image |
|---|
| MNX_ID | MNXM130544 |
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| reference | hmdb:HMDB0036253 |
| formula | C30H52O2 |
| global charge | 0 |
| mol weight | 444.744 |
| InChIKey | LJJLFLNKMQSUFO-UHFFFAOYSA-N |
| InChI | InChI=1S/C30H52O2/c1-8-21(19(2)3)10-9-20(4)24-11-12-25-28-26(14-16-30(24,25)6)29(5)15-13-23(31)17-22(29)18-27(28)32-7/h18-21,23-28,31H,8-17H2,1-7H3 |
| SMILES | CCC(CCC(C)C1CCC2C3C(OC)C=C4CC(O)CCC4(C)C3CCC12C)C(C)C |
MNX internals
| InChI (mnx) | InChI=1/C30H52O2/c1-8-21(19(2)3)10-9-20(4)24-11-12-25-28-26(14-16-30(24,25)6)29(5)15-13-23(31)17-22(29)18-27(28)32-7/h18-21,23-28,31H,8-17H2,1-7H3/t20?,21?,23?,24?,25?,26?,27?,28?,29?,30? |
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| SMILES (mnx) | [CH3:1][CH2:8][CH:21]([CH2:10][CH2:9][CH:20]([CH3:4])[CH:24]1[CH2:11][CH2:12][CH:25]2[CH:28]3[CH:26]([CH2:14][CH2:16][C:30]12[CH3:6])[C:29]1([CH3:5])[CH2:15][CH2:13][CH:23]([OH:31])[CH2:17][C:22]1=[CH:18][CH:27]3[O:32][CH3:7])[CH:19]([CH3:2])[CH3:3] |
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