| Properties | Image |
|---|
| MNX_ID | MNXM104051 |
 |
| reference | chebi:70119 |
| formula | C30H50O2 |
| global charge | 0 |
| mol weight | 442.728 |
| InChIKey | FEAAYJYTVFABGY-UHNHVWPPSA-N |
| InChI | InChI=1S/C30H50O2/c1-19(2)10-9-11-20(3)21-14-16-29(7)22-12-13-24-27(4,5)25(31)18-26(32)30(24,8)23(22)15-17-28(21,29)6/h13,19-23,26,32H,9-12,14-18H2,1-8H3/t20-,21-,22+,23-,26+,28-,29+,30+/m0/s1 |
| SMILES | CC(C)CCC[C@H](C)[C@@H]1CC[C@]2(C)[C@@H]3CC=C4C(C)(C)C(=O)C[C@@H](O)[C@]4(C)[C@H]3CC[C@@]12C |
MNX internals
| InChI (mnx) | InChI=1/C30H50O2/c1-19(2)10-9-11-20(3)21-14-16-29(7)22-12-13-24-27(4,5)25(31)18-26(32)30(24,8)23(22)15-17-28(21,29)6/h13,19-23,26,32H,9-12,14-18H2,1-8H3/t20-,21-,22+,23-,26+,28-,29+,30+/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH:19]([CH3:2])[CH2:10][CH2:9][CH2:11][C@H:20]([CH3:3])[C@@H:21]1[CH2:14][CH2:16][C@:29]2([CH3:7])[C@@H:22]3[CH2:12][CH:13]=[C:24]4[C:27]([CH3:4])([CH3:5])[C:25](=[O:31])[CH2:18][C@@H:26]([OH:32])[C@:30]4([CH3:8])[C@H:23]3[CH2:15][CH2:17][C@@:28]12[CH3:6] |
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