Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C33H46NO13.Na |
| Molecular Weight | 687.707 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 14 / 14 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[H][C@@]12C[C@H](O)C[C@]3(O)C[C@H](O)[C@@H](C([O-])=O)[C@]([H])(C[C@@]([H])(O[C@@H]4O[C@H](C)[C@@H](O)[C@H](N)[C@@H]4O)\C=C\C=C\C=C\C=C\C[C@@H](C)OC(=O)\C=C\[C@@]1([H])O2)O3
InChI
InChIKey=CBRIFMNOKRNQEF-KTYYKLRQSA-M
InChI=1S/C33H47NO13.Na/c1-18-10-8-6-4-3-5-7-9-11-21(45-32-30(39)28(34)29(38)19(2)44-32)15-25-27(31(40)41)22(36)17-33(42,47-25)16-20(35)14-24-23(46-24)12-13-26(37)43-18;/h3-9,11-13,18-25,27-30,32,35-36,38-39,42H,10,14-17,34H2,1-2H3,(H,40,41);/q;+1/p-1/b4-3+,7-5+,8-6+,11-9+,13-12+;/t18-,19-,20+,21+,22+,23-,24-,25+,27-,28+,29-,30+,32+,33-;/m1./s1
| Molecular Formula | Na |
| Molecular Weight | 22.9898 |
| Charge | 1 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C33H46NO13 |
| Molecular Weight | 664.7172 |
| Charge | -1 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 14 / 14 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 11:38:22 UTC 2023
by
admin
on
Sat Dec 16 11:38:22 UTC 2023
|
| Record UNII |
E97SA84U57
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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137331870
Created by
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31634-95-4
Created by
admin on Sat Dec 16 11:38:22 UTC 2023 , Edited by admin on Sat Dec 16 11:38:22 UTC 2023
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E97SA84U57
Created by
admin on Sat Dec 16 11:38:22 UTC 2023 , Edited by admin on Sat Dec 16 11:38:22 UTC 2023
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PRIMARY |