| Properties | Image |
|---|
| MNX_ID | MNXM103048 |
 |
| reference | chebi:69021 |
| formula | C26H32O7 |
| global charge | 0 |
| mol weight | 456.535 |
| InChIKey | RBGYOLFHIDJTOX-VMXKAMJHSA-N |
| InChI | InChI=1S/C26H32O7/c1-13-15-11-18(27)33-22(3,4)16(15)9-10-24(6)17(13)12-23(5)14(2)26(24,21(30)32-8)20(29)25(7,31)19(23)28/h9,17,31H,2,10-12H2,1,3-8H3/t17-,23+,24-,25-,26-/m0/s1 |
| SMILES | C=C1[C@@]2(C)C[C@H]3C(C)=C4CC(=O)OC(C)(C)C4=CC[C@]3(C)[C@]1(C(=O)OC)C(=O)[C@@](C)(O)C2=O |
MNX internals
| InChI (mnx) | InChI=1/C26H32O7/c1-13-15-11-18(27)33-22(3,4)16(15)9-10-24(6)17(13)12-23(5)14(2)26(24,21(30)32-8)20(29)25(7,31)19(23)28/h9,17,31H,2,10-12H2,1,3-8H3/t17-,23+,24-,25-,26-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][C:13]1=[C:15]2[CH2:11][C:18](=[O:27])[O:33][C:22]([CH3:3])([CH3:4])[C:16]2=[CH:9][CH2:10][C@@:24]2([CH3:6])[C@H:17]1[CH2:12][C@:23]1([CH3:5])[C:14](=[CH2:2])[C@@:26]2([C:21](=[O:30])[O:32][CH3:8])[C:20](=[O:29])[C@@:25]([CH3:7])([OH:31])[C:19]1=[O:28] |
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