| Properties | Image |
|---|
| MNX_ID | MNXM1179976 |
 |
| reference | envipathM:...eb32155443dd |
| formula | C26H43O7 |
| global charge | -1 |
| mol weight | 467.623 |
| InChIKey | YGWMFWGNNPGURB-UHFFFAOYSA-M |
| InChI | InChI=1S/C26H44O7/c1-5-26(33)19-11-14(27)12-20(29)25(19,4)17-8-9-24(3)15(13(2)10-18(28)23(31)32)6-7-16(24)21(17)22(26)30/h13-22,27-30,33H,5-12H2,1-4H3,(H,31,32)/p-1 |
| SMILES | CCC1(O)C(O)C2C3CCC(C(C)CC(O)C(=O)[O-])C3(C)CCC2C2(C)C(O)CC(O)CC12 |
MNX internals
| InChI (mnx) | InChI=1/C26H44O7/c1-5-26(33)19-11-14(27)12-20(29)25(19,4)17-8-9-24(3)15(13(2)10-18(28)23(31)32)6-7-16(24)21(17)22(26)30/h13-22,27-30,33H,5-12H2,1-4H3,(H,31,32)/t13?,14?,15?,16?,17?,18?,19?,20?,21?,22?,24?,25?,26? |
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| SMILES (mnx) | [CH3:1][CH2:5][C:26]1([OH:33])[CH:19]2[CH2:11][CH:14]([OH:27])[CH2:12][CH:20]([OH:29])[C:25]2([CH3:4])[CH:17]2[CH2:8][CH2:9][C:24]3([CH3:3])[CH:15]([CH:13]([CH3:2])[CH2:10][CH:18]([C:23](=[O:31])[OH:32])[OH:28])[CH2:6][CH2:7][CH:16]3[CH:21]2[CH:22]1[OH:30] |
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