| Properties | Image |
|---|
| MNX_ID | MNXM103645 |
 |
| reference | chebi:68083 |
| formula | C28H46O3 |
| global charge | 0 |
| mol weight | 430.673 |
| InChIKey | ARXHRTZAVQOQEU-BRVLHLJYSA-N |
| InChI | InChI=1S/C28H46O3/c1-17(2)18(3)7-8-19(4)22-9-10-23-21-15-25(30)28(31)16-20(29)11-14-27(28,6)24(21)12-13-26(22,23)5/h7-8,15,17-20,22-25,29-31H,9-14,16H2,1-6H3/b8-7+/t18-,19+,20-,22+,23-,24-,25+,26+,27+,28-/m0/s1 |
| SMILES | CC(C)[C@@H](C)/C=C/[C@@H](C)[C@H]1CC[C@H]2C3=C[C@@H](O)[C@@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |
MNX internals
| InChI (mnx) | InChI=1/C28H46O3/c1-17(2)18(3)7-8-19(4)22-9-10-23-21-15-25(30)28(31)16-20(29)11-14-27(28,6)24(21)12-13-26(22,23)5/h7-8,15,17-20,22-25,29-31H,9-14,16H2,1-6H3/b8-7+/t18-,19+,20-,22+,23-,24-,25+,26+,27+,28-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH:17]([CH3:2])[C@@H:18]([CH3:3])/[CH:7]=[CH:8]/[C@@H:19]([CH3:4])[C@H:22]1[CH2:9][CH2:10][C@H:23]2[C:21]3=[CH:15][C@@H:25]([OH:30])[C@@:28]4([OH:31])[CH2:16][C@@H:20]([OH:29])[CH2:11][CH2:14][C@:27]4([CH3:6])[C@H:24]3[CH2:12][CH2:13][C@:26]12[CH3:5] |
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