| Properties | Image |
|---|
| MNX_ID | MNXM1171373 |
 |
| reference | envipathM:...01580af8c83f |
| formula | C41H58O16 |
| global charge | 0 |
| mol weight | 806.899 |
| InChIKey | MNQAZAGMNHYTGC-UHFFFAOYSA-N |
| InChI | InChI=1S/C41H58O16/c1-18-35(48)25(42)12-32(52-18)56-37-20(3)54-33(14-27(37)44)57-36-19(2)53-31(13-26(36)43)55-22-6-8-38(4)24-11-29(46)39(5)34(21-10-30(47)51-17-21)28(45)16-41(39,50)23(24)7-9-40(38,49)15-22/h10,18-20,22-24,27-29,31-34,36-37,44-46,49-50H,6-9,11-17H2,1-5H3 |
| SMILES | CC1OC(OC2C(O)CC(OC3C(=O)CC(OC4CCC5(C)C6CC(O)C7(C)C(C8=CC(=O)OC8)C(O)CC7(O)C6CCC5(O)C4)OC3C)OC2C)CC(=O)C1=O |
MNX internals
| InChI (mnx) | InChI=1/C41H58O16/c1-18-35(48)25(42)12-32(52-18)56-37-20(3)54-33(14-27(37)44)57-36-19(2)53-31(13-26(36)43)55-22-6-8-38(4)24-11-29(46)39(5)34(21-10-30(47)51-17-21)28(45)16-41(39,50)23(24)7-9-40(38,49)15-22/h10,18-20,22-24,27-29,31-34,36-37,44-46,49-50H,6-9,11-17H2,1-5H3/t18?,19?,20?,22?,23?,24?,27?,28?,29?,31?,32?,33?,34?,36?,37?,38?,39?,40?,41? |
 |
| SMILES (mnx) | [CH3:1][CH:18]1[C:35](=[O:48])[C:25](=[O:42])[CH2:12][CH:32]([O:56][CH:37]2[CH:20]([CH3:3])[O:54][CH:33]([O:57][CH:36]3[CH:19]([CH3:2])[O:53][CH:31]([O:55][CH:22]4[CH2:6][CH2:8][C:38]5([CH3:4])[CH:24]6[CH2:11][CH:29]([OH:46])[C:39]7([CH3:5])[CH:34]([C:21]8=[CH:10][C:30](=[O:47])[O:51][CH2:17]8)[CH:28]([OH:45])[CH2:16][C:41]7([OH:50])[CH:23]6[CH2:7][CH2:9][C:40]5([OH:49])[CH2:15]4)[CH2:13][C:26]3=[O:43])[CH2:14][CH:27]2[OH:44])[O:52]1 |
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