| Properties | Image |
|---|
| MNX_ID | MNXM1174699 |
 |
| reference | envipathM:...a348d44e88fc |
| formula | C41H60O15 |
| global charge | 0 |
| mol weight | 792.916 |
| InChIKey | TVTCKRBFUINVST-UHFFFAOYSA-N |
| InChI | InChI=1S/C41H60O15/c1-18-36(48)27(42)14-34(51-18)55-38-20(3)53-35(16-29(38)44)56-37-19(2)52-33(15-28(37)43)54-23-11-22-6-7-25-26(39(22,4)30(45)12-23)13-31(46)40(5)24(8-9-41(25,40)49)21-10-32(47)50-17-21/h18-26,29-30,33-38,44-45,48-49H,6-17H2,1-5H3 |
| SMILES | CC1OC(OC2C(O)CC(OC3C(=O)CC(OC4CC(O)C5(C)C(CCC6C5CC(=O)C5(C)C(C7COC(=O)C7)CCC65O)C4)OC3C)OC2C)CC(=O)C1O |
MNX internals
| InChI (mnx) | InChI=1/C41H60O15/c1-18-36(48)27(42)14-34(51-18)55-38-20(3)53-35(16-29(38)44)56-37-19(2)52-33(15-28(37)43)54-23-11-22-6-7-25-26(39(22,4)30(45)12-23)13-31(46)40(5)24(8-9-41(25,40)49)21-10-32(47)50-17-21/h18-26,29-30,33-38,44-45,48-49H,6-17H2,1-5H3/t18?,19?,20?,21?,22?,23?,24?,25?,26?,29?,30?,33?,34?,35?,36?,37?,38?,39?,40?,41? |
 |
| SMILES (mnx) | [CH3:1][CH:18]1[CH:36]([OH:48])[C:27](=[O:42])[CH2:14][CH:34]([O:55][CH:38]2[CH:20]([CH3:3])[O:53][CH:35]([O:56][CH:37]3[CH:19]([CH3:2])[O:52][CH:33]([O:54][CH:23]4[CH2:11][CH:22]5[CH2:6][CH2:7][CH:25]6[CH:26]([CH2:13][C:31](=[O:46])[C:40]7([CH3:5])[CH:24]([CH:21]8[CH2:10][C:32](=[O:47])[O:50][CH2:17]8)[CH2:8][CH2:9][C:41]67[OH:49])[C:39]5([CH3:4])[CH:30]([OH:45])[CH2:12]4)[CH2:15][C:28]3=[O:43])[CH2:16][CH:29]2[OH:44])[O:51]1 |
|