| Properties | Image |
|---|
| MNX_ID | MNXM1195986 |
 |
| reference | envipathM:...77f384d8ee4f |
| formula | C41H66O19 |
| global charge | 0 |
| mol weight | 862.96 |
| InChIKey | OBLBHDVWKXSIAJ-UHFFFAOYSA-N |
| InChI | InChI=1S/C41H66O19/c1-17-34(50)22(43)10-31(55-17)59-35-18(2)56-32(11-23(35)44)60-36-24(45)12-33(58-25(36)15-42)57-19-7-27(46)37(3)20-8-28(47)38(4)26(39(51)14-30(49)54-16-39)5-6-40(38,52)21(20)9-29(48)41(37,53)13-19/h17-29,31-36,42-48,50-53H,5-16H2,1-4H3 |
| SMILES | CC1OC(OC2C(O)CC(OC3C(O)CC(OC4CC(O)C5(C)C6CC(O)C7(C)C(C8(O)COC(=O)C8)CCC7(O)C6CC(O)C5(O)C4)OC3CO)OC2C)CC(O)C1O |
MNX internals
| InChI (mnx) | InChI=1/C41H66O19/c1-17-34(50)22(43)10-31(55-17)59-35-18(2)56-32(11-23(35)44)60-36-24(45)12-33(58-25(36)15-42)57-19-7-27(46)37(3)20-8-28(47)38(4)26(39(51)14-30(49)54-16-39)5-6-40(38,52)21(20)9-29(48)41(37,53)13-19/h17-29,31-36,42-48,50-53H,5-16H2,1-4H3/t17?,18?,19?,20?,21?,22?,23?,24?,25?,26?,27?,28?,29?,31?,32?,33?,34?,35?,36?,37?,38?,39?,40?,41? |
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| SMILES (mnx) | [CH3:1][CH:17]1[CH:34]([OH:50])[CH:22]([OH:43])[CH2:10][CH:31]([O:59][CH:35]2[CH:18]([CH3:2])[O:56][CH:32]([O:60][CH:36]3[CH:24]([OH:45])[CH2:12][CH:33]([O:57][CH:19]4[CH2:7][CH:27]([OH:46])[C:37]5([CH3:3])[CH:20]6[CH2:8][CH:28]([OH:47])[C:38]7([CH3:4])[CH:26]([C:39]8([OH:51])[CH2:14][C:30](=[O:49])[O:54][CH2:16]8)[CH2:5][CH2:6][C:40]7([OH:52])[CH:21]6[CH2:9][CH:29]([OH:48])[C:41]5([OH:53])[CH2:13]4)[O:58][CH:25]3[CH2:15][OH:42])[CH2:11][CH:23]2[OH:44])[O:55]1 |
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