| Properties | Image |
|---|
| MNX_ID | MNXM1180425 |
 |
| reference | envipathM:...647f9fd75b40 |
| formula | C41H60O16 |
| global charge | 0 |
| mol weight | 808.915 |
| InChIKey | WQHHYEMWOIWDNV-UHFFFAOYSA-N |
| InChI | InChI=1S/C41H60O16/c1-18-24(22-10-32(48)51-17-22)6-7-26(42)36-25(11-27(18)43)40(5)9-8-23(15-41(40,50)16-31(36)47)55-33-13-29(45)38(20(3)53-33)57-35-14-30(46)39(21(4)54-35)56-34-12-28(44)37(49)19(2)52-34/h10,18-21,23-25,29-31,33-39,45-47,49-50H,6-9,11-17H2,1-5H3 |
| SMILES | CC1OC(OC2C(O)CC(OC3C(O)CC(OC4CCC5(C)C6CC(=O)C(C)C(C7=CC(=O)OC7)CCC(=O)C6C(O)CC5(O)C4)OC3C)OC2C)CC(=O)C1O |
MNX internals
| InChI (mnx) | InChI=1/C41H60O16/c1-18-24(22-10-32(48)51-17-22)6-7-26(42)36-25(11-27(18)43)40(5)9-8-23(15-41(40,50)16-31(36)47)55-33-13-29(45)38(20(3)53-33)57-35-14-30(46)39(21(4)54-35)56-34-12-28(44)37(49)19(2)52-34/h10,18-21,23-25,29-31,33-39,45-47,49-50H,6-9,11-17H2,1-5H3/t18?,19?,20?,21?,23?,24?,25?,29?,30?,31?,33?,34?,35?,36?,37?,38?,39?,40?,41? |
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| SMILES (mnx) | [CH3:1][CH:18]1[CH:24]([C:22]2=[CH:10][C:32](=[O:48])[O:51][CH2:17]2)[CH2:6][CH2:7][C:26](=[O:42])[CH:36]2[CH:25]([CH2:11][C:27]1=[O:43])[C:40]1([CH3:5])[CH2:9][CH2:8][CH:23]([O:55][CH:33]3[CH2:13][CH:29]([OH:45])[CH:38]([O:57][CH:35]4[CH2:14][CH:30]([OH:46])[CH:39]([O:56][CH:34]5[CH2:12][C:28](=[O:44])[CH:37]([OH:49])[CH:19]([CH3:2])[O:52]5)[CH:21]([CH3:4])[O:54]4)[CH:20]([CH3:3])[O:53]3)[CH2:15][C:41]1([OH:50])[CH2:16][CH:31]2[OH:47] |
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