| Properties | Image |
|---|
| MNX_ID | MNXM25996 |
 |
| reference | lipidmapsM:LMST01060002 |
| formula | C30H52O |
| global charge | 0 |
| mol weight | 428.745 |
| InChIKey | HSYBQACFKPFBJN-SMBVQPOTSA-N |
| InChI | InChI=1S/C30H52O/c1-18(2)20(4)30(7)17-27(30)19(3)24-10-11-25-23-9-8-21-16-22(31)12-14-28(21,5)26(23)13-15-29(24,25)6/h18-27,31H,8-17H2,1-7H3/t19?,20-,21+,22+,23+,24-,25+,26+,27-,28+,29-,30-/m1/s1 |
| SMILES | CC(C)[C@@H](C)[C@@]1(C)C[C@@H]1C(C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |
MNX internals
| InChI (mnx) | InChI=1/C30H52O/c1-18(2)20(4)30(7)17-27(30)19(3)24-10-11-25-23-9-8-21-16-22(31)12-14-28(21,5)26(23)13-15-29(24,25)6/h18-27,31H,8-17H2,1-7H3/t19?,20-,21+,22+,23+,24-,25+,26+,27-,28+,29-,30-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH:18]([CH3:2])[C@@H:20]([CH3:4])[C@@:30]1([CH3:7])[CH2:17][C@@H:27]1[CH:19]([CH3:3])[C@H:24]1[CH2:10][CH2:11][C@H:25]2[C@@H:23]3[CH2:9][CH2:8][C@H:21]4[CH2:16][C@@H:22]([OH:31])[CH2:12][CH2:14][C@:28]4([CH3:5])[C@H:26]3[CH2:13][CH2:15][C@:29]12[CH3:6] |
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