| Properties | Image |
|---|
| MNX_ID | MNXM1196529 |
 |
| reference | envipathM:...77d528c0444c |
| formula | C41H60O15 |
| global charge | 0 |
| mol weight | 792.916 |
| InChIKey | VQQQXSAKNZGULL-UHFFFAOYSA-N |
| InChI | InChI=1S/C41H60O15/c1-19-36(48)27(43)14-33(51-19)55-37-20(2)52-34(15-28(37)44)56-38-29(45)16-35(54-30(38)17-42)53-23-7-9-39(3)22(12-23)5-6-25-26(39)13-31(46)40(4)24(8-10-41(25,40)49)21-11-32(47)50-18-21/h17,19-27,29-31,33-35,37-38,43,45-46,49H,5-16,18H2,1-4H3 |
| SMILES | CC1OC(OC2C(=O)CC(OC3C(O)CC(OC4CCC5(C)C(CCC6C5CC(O)C5(C)C(C7COC(=O)C7)CCC65O)C4)OC3C=O)OC2C)CC(O)C1=O |
MNX internals
| InChI (mnx) | InChI=1/C41H60O15/c1-19-36(48)27(43)14-33(51-19)55-37-20(2)52-34(15-28(37)44)56-38-29(45)16-35(54-30(38)17-42)53-23-7-9-39(3)22(12-23)5-6-25-26(39)13-31(46)40(4)24(8-10-41(25,40)49)21-11-32(47)50-18-21/h17,19-27,29-31,33-35,37-38,43,45-46,49H,5-16,18H2,1-4H3/t19?,20?,21?,22?,23?,24?,25?,26?,27?,29?,30?,31?,33?,34?,35?,37?,38?,39?,40?,41? |
 |
| SMILES (mnx) | [CH3:1][CH:19]1[C:36](=[O:48])[CH:27]([OH:43])[CH2:14][CH:33]([O:55][CH:37]2[CH:20]([CH3:2])[O:52][CH:34]([O:56][CH:38]3[CH:29]([OH:45])[CH2:16][CH:35]([O:53][CH:23]4[CH2:7][CH2:9][C:39]5([CH3:3])[CH:22]([CH2:5][CH2:6][CH:25]6[CH:26]5[CH2:13][CH:31]([OH:46])[C:40]5([CH3:4])[CH:24]([CH:21]7[CH2:11][C:32](=[O:47])[O:50][CH2:18]7)[CH2:8][CH2:10][C:41]65[OH:49])[CH2:12]4)[O:54][CH:30]3[CH:17]=[O:42])[CH2:15][C:28]2=[O:44])[O:51]1 |
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