| Properties | Image |
|---|
| MNX_ID | MNXM1185886 |
 |
| reference | envipathM:...80ebd90c53e2 |
| formula | C41H62O16 |
| global charge | 0 |
| mol weight | 810.931 |
| InChIKey | ULUUAVMUIWIRRZ-UHFFFAOYSA-N |
| InChI | InChI=1S/C41H62O16/c1-18-34(48)25(42)13-32(52-18)56-36-20(3)54-33(15-27(36)44)57-35-19(2)53-31(14-26(35)43)55-23-6-8-38(4)22(11-23)12-28(45)37-40(49)9-7-24(21-10-30(47)51-17-21)39(40,5)29(46)16-41(37,38)50/h18-25,27-29,31-33,35-37,42,44-46,49-50H,6-17H2,1-5H3 |
| SMILES | CC1OC(OC2C(O)CC(OC3C(=O)CC(OC4CCC5(C)C(C4)CC(O)C4C5(O)CC(O)C5(C)C(C6COC(=O)C6)CCC45O)OC3C)OC2C)CC(O)C1=O |
MNX internals
| InChI (mnx) | InChI=1/C41H62O16/c1-18-34(48)25(42)13-32(52-18)56-36-20(3)54-33(15-27(36)44)57-35-19(2)53-31(14-26(35)43)55-23-6-8-38(4)22(11-23)12-28(45)37-40(49)9-7-24(21-10-30(47)51-17-21)39(40,5)29(46)16-41(37,38)50/h18-25,27-29,31-33,35-37,42,44-46,49-50H,6-17H2,1-5H3/t18?,19?,20?,21?,22?,23?,24?,25?,27?,28?,29?,31?,32?,33?,35?,36?,37?,38?,39?,40?,41? |
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| SMILES (mnx) | [CH3:1][CH:18]1[C:34](=[O:48])[CH:25]([OH:42])[CH2:13][CH:32]([O:56][CH:36]2[CH:20]([CH3:3])[O:54][CH:33]([O:57][CH:35]3[CH:19]([CH3:2])[O:53][CH:31]([O:55][CH:23]4[CH2:6][CH2:8][C:38]5([CH3:4])[CH:22]([CH2:11]4)[CH2:12][CH:28]([OH:45])[CH:37]4[C:40]6([OH:49])[CH2:9][CH2:7][CH:24]([CH:21]7[CH2:10][C:30](=[O:47])[O:51][CH2:17]7)[C:39]6([CH3:5])[CH:29]([OH:46])[CH2:16][C:41]45[OH:50])[CH2:14][C:26]3=[O:43])[CH2:15][CH:27]2[OH:44])[O:52]1 |
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