| Properties | Image |
|---|
| MNX_ID | MNXM1187790 |
 |
| reference | envipathM:...0a754a9ed963 |
| formula | C26H35O7 |
| global charge | -1 |
| mol weight | 459.559 |
| InChIKey | VBQIWWWKSQQZSZ-JGDVUBNHSA-M |
| InChI | InChI=1S/C26H36O7/c1-18(2)13-14-20-25(3,33-20)24-23(30-4)19(15-16-26(24)17-31-26)32-22(29)12-10-8-6-5-7-9-11-21(27)28/h6,8-13,19-20,23-24H,5,7,14-17H2,1-4H3,(H,27,28)/p-1/b8-6+,11-9+,12-10+/t19-,20-,23-,24-,25+,26+/m1/s1 |
| SMILES | CO[C@@H]1[C@H](OC(=O)/C=C/C=C/CC/C=C/C(=O)[O-])CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C |
MNX internals
| InChI (mnx) | InChI=1/C26H36O7/c1-18(2)13-14-20-25(3,33-20)24-23(30-4)19(15-16-26(24)17-31-26)32-22(29)12-10-8-6-5-7-9-11-21(27)28/h6,8-13,19-20,23-24H,5,7,14-17H2,1-4H3,(H,27,28)/b8-6+,11-9+,12-10+/t19-,20-,23-,24-,25+,26+/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][C:18]([CH3:2])=[CH:13][CH2:14][C@@H:20]1[C@@:25]([CH3:3])([C@H:24]2[C@H:23]([O:30][CH3:4])[C@H:19]([O:32][C:22](/[CH:12]=[CH:10]/[CH:8]=[CH:6]/[CH2:5][CH2:7]/[CH:9]=[CH:11]/[C:21](=[O:27])[OH:28])=[O:29])[CH2:15][CH2:16][C@:26]23[CH2:17][O:31]3)[O:33]1 |
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