| Properties | Image |
|---|
| MNX_ID | MNXM1189617 |
 |
| reference | envipathM:...a84c59c4b835 |
| formula | C41H60O17 |
| global charge | 0 |
| mol weight | 824.914 |
| InChIKey | DLNLQUQGXZTGTO-UHFFFAOYSA-N |
| InChI | InChI=1S/C41H60O17/c1-18-34(49)24(43)12-32(53-18)58-36-26(45)14-33(56-28(36)16-42)57-35-19(2)54-31(13-25(35)44)55-22-5-7-38(3)21(10-22)11-27(46)37-40(50)8-6-23(20-9-30(48)52-17-20)39(40,4)29(47)15-41(37,38)51/h9,18-19,21-23,25,27-29,31-37,42,44,46-47,49-51H,5-8,10-17H2,1-4H3 |
| SMILES | CC1OC(OC2C(=O)CC(OC3C(O)CC(OC4CCC5(C)C(C4)CC(O)C4C5(O)CC(O)C5(C)C(C6=CC(=O)OC6)CCC45O)OC3C)OC2CO)CC(=O)C1O |
MNX internals
| InChI (mnx) | InChI=1/C41H60O17/c1-18-34(49)24(43)12-32(53-18)58-36-26(45)14-33(56-28(36)16-42)57-35-19(2)54-31(13-25(35)44)55-22-5-7-38(3)21(10-22)11-27(46)37-40(50)8-6-23(20-9-30(48)52-17-20)39(40,4)29(47)15-41(37,38)51/h9,18-19,21-23,25,27-29,31-37,42,44,46-47,49-51H,5-8,10-17H2,1-4H3/t18?,19?,21?,22?,23?,25?,27?,28?,29?,31?,32?,33?,34?,35?,36?,37?,38?,39?,40?,41? |
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| SMILES (mnx) | [CH3:1][CH:18]1[CH:34]([OH:49])[C:24](=[O:43])[CH2:12][CH:32]([O:58][CH:36]2[C:26](=[O:45])[CH2:14][CH:33]([O:57][CH:35]3[CH:19]([CH3:2])[O:54][CH:31]([O:55][CH:22]4[CH2:5][CH2:7][C:38]5([CH3:3])[CH:21]([CH2:10]4)[CH2:11][CH:27]([OH:46])[CH:37]4[C:40]6([OH:50])[CH2:8][CH2:6][CH:23]([C:20]7=[CH:9][C:30](=[O:48])[O:52][CH2:17]7)[C:39]6([CH3:4])[CH:29]([OH:47])[CH2:15][C:41]45[OH:51])[CH2:13][CH:25]3[OH:44])[O:56][CH:28]2[CH2:16][OH:42])[O:53]1 |
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