| Properties | Image |
|---|
| MNX_ID | MNXM1188606 |
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| reference | envipathM:...aa6d2e29d353 |
| formula | C41H62O15 |
| global charge | 0 |
| mol weight | 794.932 |
| InChIKey | QNHCYFCMSZTGKE-UHFFFAOYSA-N |
| InChI | InChI=1S/C41H62O15/c1-19-35(47)27(42)15-33(51-19)55-37-21(3)53-34(17-29(37)44)56-36-20(2)52-32(16-28(36)43)54-24-8-9-38(4)22(12-24)6-7-25-26(38)14-30(45)39(5)40(48,10-11-41(25,39)49)23-13-31(46)50-18-23/h19-29,32-34,36-37,42-44,48-49H,6-18H2,1-5H3 |
| SMILES | CC1OC(OC2C(O)CC(OC3C(O)CC(OC4CCC5(C)C(CCC6C5CC(=O)C5(C)C(O)(C7COC(=O)C7)CCC65O)C4)OC3C)OC2C)CC(O)C1=O |
MNX internals
| InChI (mnx) | InChI=1/C41H62O15/c1-19-35(47)27(42)15-33(51-19)55-37-21(3)53-34(17-29(37)44)56-36-20(2)52-32(16-28(36)43)54-24-8-9-38(4)22(12-24)6-7-25-26(38)14-30(45)39(5)40(48,10-11-41(25,39)49)23-13-31(46)50-18-23/h19-29,32-34,36-37,42-44,48-49H,6-18H2,1-5H3/t19?,20?,21?,22?,23?,24?,25?,26?,27?,28?,29?,32?,33?,34?,36?,37?,38?,39?,40?,41? |
 |
| SMILES (mnx) | [CH3:1][CH:19]1[C:35](=[O:47])[CH:27]([OH:42])[CH2:15][CH:33]([O:55][CH:37]2[CH:21]([CH3:3])[O:53][CH:34]([O:56][CH:36]3[CH:20]([CH3:2])[O:52][CH:32]([O:54][CH:24]4[CH2:8][CH2:9][C:38]5([CH3:4])[CH:22]([CH2:6][CH2:7][CH:25]6[CH:26]5[CH2:14][C:30](=[O:45])[C:39]5([CH3:5])[C:40]([CH:23]7[CH2:13][C:31](=[O:46])[O:50][CH2:18]7)([OH:48])[CH2:10][CH2:11][C:41]65[OH:49])[CH2:12]4)[CH2:16][CH:28]3[OH:43])[CH2:17][CH:29]2[OH:44])[O:51]1 |
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