| Properties | Image |
|---|
| MNX_ID | MNXM1128779 |
 |
| reference | chebi:167548 |
| formula | C25H38O3 |
| global charge | 0 |
| mol weight | 386.576 |
| InChIKey | PLWMYIADTRHIMY-BNFAVABNSA-N |
| InChI | InChI=1S/C25H38O3/c1-16(2)7-6-8-17(3)19-11-12-24(4)13-21-23(22(27)14-25(21,5)28)18(15-26)9-10-20(19)24/h7,9,15,17,19-21,23,28H,6,8,10-14H2,1-5H3/b18-9-/t17-,19+,20-,21-,23+,24+,25+/m0/s1 |
| SMILES | CC(C)=CCC[C@H](C)[C@H]1CC[C@]2(C)C[C@H]3[C@H](C(=O)C[C@@]3(C)O)/C(C=O)=C\C[C@@H]12 |
MNX internals
| InChI (mnx) | InChI=1/C25H38O3/c1-16(2)7-6-8-17(3)19-11-12-24(4)13-21-23(22(27)14-25(21,5)28)18(15-26)9-10-20(19)24/h7,9,15,17,19-21,23,28H,6,8,10-14H2,1-5H3/b18-9-/t17-,19+,20-,21-,23+,24+,25+/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][C:16]([CH3:2])=[CH:7][CH2:6][CH2:8][C@H:17]([CH3:3])[C@H:19]1[CH2:11][CH2:12][C@:24]2([CH3:4])[CH2:13][C@H:21]3[C@@H:23](/[C:18]([CH:15]=[O:26])=[CH:9]\[CH2:10][C@@H:20]12)[C:22](=[O:27])[CH2:14][C@@:25]3([CH3:5])[OH:28] |
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