| Properties | Image |
|---|
| MNX_ID | MNXM57966 |
 |
| reference | chebi:140138 |
| formula | C20H32O5 |
| global charge | 0 |
| mol weight | 352.471 |
| InChIKey | LLNZGRNLXLQFAC-KLKQSVAXSA-N |
| InChI | InChI=1S/C20H32O5/c1-10-11-5-6-12-16(23)19(11,9-18(12,4)24)8-15(22)20(25)13(10)7-14(21)17(20,2)3/h12-16,21-25H,5-9H2,1-4H3/t12-,13+,14+,15-,16-,18-,19+,20+/m1/s1 |
| SMILES | CC1=C2CC[C@@H]3[C@@H](O)[C@@]2(C[C@@H](O)[C@@]2(O)[C@H]1C[C@H](O)C2(C)C)C[C@@]3(C)O |
MNX internals
| InChI (mnx) | InChI=1/C20H32O5/c1-10-11-5-6-12-16(23)19(11,9-18(12,4)24)8-15(22)20(25)13(10)7-14(21)17(20,2)3/h12-16,21-25H,5-9H2,1-4H3/t12-,13+,14+,15-,16-,18-,19+,20+/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][C:10]1=[C:11]2[CH2:5][CH2:6][C@@H:12]3[C@@H:16]([OH:23])[C@@:19]2([CH2:8][C@@H:15]([OH:22])[C@@:20]2([OH:25])[C@H:13]1[CH2:7][C@H:14]([OH:21])[C:17]2([CH3:2])[CH3:3])[CH2:9][C@@:18]3([CH3:4])[OH:24] |
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