| Properties | Image |
|---|
| MNX_ID | MNXM148024 |
 |
| reference | chebi:232445 |
| formula | C27H34O7 |
| global charge | 0 |
| mol weight | 470.562 |
| InChIKey | YSZFXAVEXUBSAP-YGDRGTHPSA-N |
| InChI | InChI=1S/C27H34O7/c1-14(28)33-19-18-20(30)32-13-27(18)25(6)11-16-23(4)9-8-17(29)34-22(2,3)15(23)7-10-26(16,27)12-24(19,5)21(25)31/h8-9,15-16,18-19H,7,10-13H2,1-6H3/t15-,16-,18+,19+,23-,24-,25-,26-,27+/m0/s1 |
| SMILES | CC(=O)O[C@@H]1[C@@H]2C(=O)OC[C@@]23[C@]24CC[C@H]5C(C)(C)OC(=O)C=C[C@]5(C)[C@@H]2C[C@@]3(C)C(=O)[C@@]1(C)C4 |
MNX internals
| InChI (mnx) | InChI=1/C27H34O7/c1-14(28)33-19-18-20(30)32-13-27(18)25(6)11-16-23(4)9-8-17(29)34-22(2,3)15(23)7-10-26(16,27)12-24(19,5)21(25)31/h8-9,15-16,18-19H,7,10-13H2,1-6H3/t15-,16-,18+,19+,23-,24-,25?,26-,27+/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][C:14](=[O:28])[O:33][C@@H:19]1[C@@H:18]2[C:20](=[O:30])[O:32][CH2:13][C@:27]23[C@@:25]2([CH3:6])[CH2:11][C@H:16]4[C@@:23]5([CH3:4])[CH:9]=[CH:8][C:17](=[O:29])[O:34][C:22]([CH3:2])([CH3:3])[C@@H:15]5[CH2:7][CH2:10][C@:26]43[CH2:12][C@:24]1([CH3:5])[C:21]2=[O:31] |
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