| Properties | Image |
|---|
| MNX_ID | MNXM1129704 |
 |
| reference | chebi:177012 |
| formula | C25H42O5 |
| global charge | 0 |
| mol weight | 422.606 |
| InChIKey | DLYVTEULDNMQAR-SRNOMOOLSA-N |
| InChI | InChI=1S/C25H42O5/c1-14(5-8-22(29)30-4)17-6-7-18-23-19(13-21(28)25(17,18)3)24(2)10-9-16(26)11-15(24)12-20(23)27/h14-21,23,26-28H,5-13H2,1-4H3/t14-,15+,16-,17-,18+,19+,20-,21+,23+,24+,25-/m1/s1 |
| SMILES | COC(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C |
MNX internals
| InChI (mnx) | InChI=1/C25H42O5/c1-14(5-8-22(29)30-4)17-6-7-18-23-19(13-21(28)25(17,18)3)24(2)10-9-16(26)11-15(24)12-20(23)27/h14-21,23,26-28H,5-13H2,1-4H3/t14-,15+,16-,17-,18+,19+,20-,21+,23+,24+,25-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][C@H:14]([CH2:5][CH2:8][C:22](=[O:29])[O:30][CH3:4])[C@H:17]1[CH2:6][CH2:7][C@H:18]2[C@H:23]3[C@H:19]([CH2:13][C@H:21]([OH:28])[C@:25]12[CH3:3])[C@@:24]1([CH3:2])[CH2:10][CH2:9][C@@H:16]([OH:26])[CH2:11][C@H:15]1[CH2:12][C@H:20]3[OH:27] |
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