| Properties | Image |
|---|
| MNX_ID | MNXM1173231 |
 |
| reference | envipathM:...d1e0fbaf739f |
| formula | C41H60O17 |
| global charge | 0 |
| mol weight | 824.914 |
| InChIKey | YOKNCTIIAMSTBV-UHFFFAOYSA-N |
| InChI | InChI=1S/C41H60O17/c1-18-35(49)24(43)12-33(53-18)58-37-26(45)14-34(56-27(37)16-42)57-36-19(2)54-32(13-25(36)44)55-22-5-7-38(3)21(10-22)11-30(47)41(51)28(38)15-29(46)39(4)23(6-8-40(39,41)50)20-9-31(48)52-17-20/h9,18-19,21-29,32-34,36-37,42-46,50-51H,5-8,10-17H2,1-4H3 |
| SMILES | CC1OC(OC2C(O)CC(OC3C(O)CC(OC4CCC5(C)C(CC(=O)C6(O)C5CC(O)C5(C)C(C7=CC(=O)OC7)CCC65O)C4)OC3C)OC2CO)CC(O)C1=O |
MNX internals
| InChI (mnx) | InChI=1/C41H60O17/c1-18-35(49)24(43)12-33(53-18)58-37-26(45)14-34(56-27(37)16-42)57-36-19(2)54-32(13-25(36)44)55-22-5-7-38(3)21(10-22)11-30(47)41(51)28(38)15-29(46)39(4)23(6-8-40(39,41)50)20-9-31(48)52-17-20/h9,18-19,21-29,32-34,36-37,42-46,50-51H,5-8,10-17H2,1-4H3/t18?,19?,21?,22?,23?,24?,25?,26?,27?,28?,29?,32?,33?,34?,36?,37?,38?,39?,40?,41? |
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| SMILES (mnx) | [CH3:1][CH:18]1[C:35](=[O:49])[CH:24]([OH:43])[CH2:12][CH:33]([O:58][CH:37]2[CH:26]([OH:45])[CH2:14][CH:34]([O:57][CH:36]3[CH:19]([CH3:2])[O:54][CH:32]([O:55][CH:22]4[CH2:5][CH2:7][C:38]5([CH3:3])[CH:21]([CH2:10]4)[CH2:11][C:30](=[O:47])[C:41]4([OH:51])[CH:28]5[CH2:15][CH:29]([OH:46])[C:39]5([CH3:4])[CH:23]([C:20]6=[CH:9][C:31](=[O:48])[O:52][CH2:17]6)[CH2:6][CH2:8][C:40]54[OH:50])[CH2:13][CH:25]3[OH:44])[O:56][CH:27]2[CH2:16][OH:42])[O:53]1 |
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