| Properties | Image |
|---|
| MNX_ID | MNXM1364406 |
 |
| reference | chebi:173045 |
| formula | C30H50O |
| global charge | 0 |
| mol weight | 426.729 |
| InChIKey | ONQRKEUAIJMULO-SPBTXPORSA-N |
| InChI | InChI=1S/C30H50O/c1-20(2)9-8-10-21(3)22-13-15-28(7)24-12-11-23-26(4,5)25(31)14-16-29(23)19-30(24,29)18-17-27(22,28)6/h9,21-25,31H,8,10-19H2,1-7H3/t21?,22-,23+,24+,25+,27-,28+,29-,30+/m1/s1 |
| SMILES | CC(C)=CCCC(C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@H]4C(C)(C)[C@@H](O)CC[C@@]45C[C@@]35CC[C@]12C |
MNX internals
| InChI (mnx) | InChI=1/C30H50O/c1-20(2)9-8-10-21(3)22-13-15-28(7)24-12-11-23-26(4,5)25(31)14-16-29(23)19-30(24,29)18-17-27(22,28)6/h9,21-25,31H,8,10-19H2,1-7H3/t21?,22-,23+,24+,25+,27-,28+,29-,30+/m1/s1 |
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| SMILES (mnx) | [CH3:1][C:20]([CH3:2])=[CH:9][CH2:8][CH2:10][CH:21]([CH3:3])[C@H:22]1[CH2:13][CH2:15][C@@:28]2([CH3:7])[C@@H:24]3[CH2:12][CH2:11][C@H:23]4[C:26]([CH3:4])([CH3:5])[C@@H:25]([OH:31])[CH2:14][CH2:16][C@@:29]45[CH2:19][C@@:30]35[CH2:18][CH2:17][C@:27]12[CH3:6] |
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