| Properties | Image |
|---|
| MNX_ID | MNXM1169908 |
 |
| reference | envipathM:...8f9a28746b93 |
| formula | C35H55O14 |
| global charge | -1 |
| mol weight | 699.811 |
| InChIKey | ZCHXKUMINDFRSE-UHFFFAOYSA-M |
| InChI | InChI=1S/C35H56O14/c1-15-30(42)24(37)13-29(46-15)49-31-16(2)47-28(14-25(31)38)48-17-5-7-33(3)20-12-26(39)34(4)19(18(32(43)44)10-27(40)41)6-8-35(34,45)21(20)11-23(36)22(33)9-17/h10,15-17,19-26,28-32,36-39,42-45H,5-9,11-14H2,1-4H3,(H,40,41)/p-1 |
| SMILES | CC1OC(OC2C(O)CC(OC3CCC4(C)C(C3)C(O)CC3C4CC(O)C4(C)C(C(=CC(=O)[O-])C(O)O)CCC34O)OC2C)CC(O)C1O |
MNX internals
| InChI (mnx) | InChI=1/C35H56O14/c1-15-30(42)24(37)13-29(46-15)49-31-16(2)47-28(14-25(31)38)48-17-5-7-33(3)20-12-26(39)34(4)19(18(32(43)44)10-27(40)41)6-8-35(34,45)21(20)11-23(36)22(33)9-17/h10,15-17,19-26,28-32,36-39,42-45H,5-9,11-14H2,1-4H3,(H,40,41)/b18-10?/t15?,16?,17?,19?,20?,21?,22?,23?,24?,25?,26?,28?,29?,30?,31?,33?,34?,35? |
 |
| SMILES (mnx) | [CH3:1][CH:15]1[CH:30]([OH:42])[CH:24]([OH:37])[CH2:13][CH:29]([O:49][CH:31]2[CH:16]([CH3:2])[O:47][CH:28]([O:48][CH:17]3[CH2:5][CH2:7][C:33]4([CH3:3])[CH:20]5[CH2:12][CH:26]([OH:39])[C:34]6([CH3:4])[CH:19]([C:18](=[CH:10][C:27](=[O:40])[OH:41])[CH:32]([OH:43])[OH:44])[CH2:6][CH2:8][C:35]6([OH:45])[CH:21]5[CH2:11][CH:23]([OH:36])[CH:22]4[CH2:9]3)[CH2:14][CH:25]2[OH:38])[O:46]1 |
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