| Properties | Image |
|---|
| MNX_ID | MNXM7088 |
 |
| reference | chebi:29526 |
| formula | C34H48O8 |
| global charge | 0 |
| mol weight | 584.75 |
| InChIKey | CMVQGLOOVJQBJX-JZSZVTLOSA-N |
| InChI | InChI=1S/C34H48O8/c1-19(2)29-22(5)13-14-33(42-29)17-26-16-25(41-33)12-11-21(4)28(35)20(3)9-8-10-24-18-39-31-30(38-7)23(6)15-27(32(36)40-26)34(24,31)37/h8-11,13-15,19-20,22,25-31,35,37H,12,16-18H2,1-7H3/b9-8+,21-11+,24-10+/t20-,22-,25+,26-,27-,28-,29+,30+,31+,33+,34+/m0/s1 |
| SMILES | CO[C@@H]1C(C)=C[C@H]2C(=O)O[C@H]3C[C@@H](C/C=C(\C)[C@@H](O)[C@@H](C)/C=C/C=C4\CO[C@H]1[C@@]42O)O[C@@]1(C=C[C@H](C)[C@@H](C(C)C)O1)C3 |
MNX internals
| InChI (mnx) | InChI=1/C34H48O8/c1-19(2)29-22(5)13-14-33(42-29)17-26-16-25(41-33)12-11-21(4)28(35)20(3)9-8-10-24-18-39-31-30(38-7)23(6)15-27(32(36)40-26)34(24,31)37/h8-11,13-15,19-20,22,25-31,35,37H,12,16-18H2,1-7H3/b9-8+,21-11+,24-10+/t20-,22-,25+,26-,27-,28-,29+,30+,31+,33+,34+/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH:19]([CH3:2])[C@@H:29]1[C@@H:22]([CH3:5])[CH:13]=[CH:14][C@:33]2([CH2:17][C@@H:26]3[CH2:16][C@@H:25]([CH2:12]/[CH:11]=[C:21](\[CH3:4])[C@@H:28]([OH:35])[C@@H:20]([CH3:3])/[CH:9]=[CH:8]/[CH:10]=[C:24]4\[CH2:18][O:39][C@@H:31]5[C@H:30]([O:38][CH3:7])[C:23]([CH3:6])=[CH:15][C@@H:27]([C:32](=[O:36])[O:40]3)[C@:34]45[OH:37])[O:41]2)[O:42]1 |
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