| Properties | Image |
|---|
| MNX_ID | MNXM101757 |
 |
| reference | chebi:65798 |
| formula | C30H44O4 |
| global charge | 0 |
| mol weight | 468.678 |
| InChIKey | RKRGWMZAXCZBPG-AECKPYPVSA-N |
| InChI | InChI=1S/C30H44O4/c1-25(2)16-19-18-8-9-21-27(5)12-11-22(31)26(3,4)20(27)10-13-29(21,7)28(18,6)14-15-30(19,24(33)34)17-23(25)32/h16,18,20-21H,8-15,17H2,1-7H3,(H,33,34)/t18-,20+,21-,27+,28-,29-,30-/m1/s1 |
| SMILES | CC1(C)C=C2[C@H]3CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@@]2(C(=O)O)CC1=O |
MNX internals
| InChI (mnx) | InChI=1/C30H44O4/c1-25(2)16-19-18-8-9-21-27(5)12-11-22(31)26(3,4)20(27)10-13-29(21,7)28(18,6)14-15-30(19,24(33)34)17-23(25)32/h16,18,20-21H,8-15,17H2,1-7H3,(H,33,34)/t18-,20+,21-,27+,28-,29-,30-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][C:25]1([CH3:2])[CH:16]=[C:19]2[C@H:18]3[CH2:8][CH2:9][C@@H:21]4[C@@:27]5([CH3:5])[CH2:12][CH2:11][C:22](=[O:31])[C:26]([CH3:3])([CH3:4])[C@@H:20]5[CH2:10][CH2:13][C@@:29]4([CH3:7])[C@:28]3([CH3:6])[CH2:14][CH2:15][C@@:30]2([C:24](=[O:33])[OH:34])[CH2:17][C:23]1=[O:32] |
|