Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C46H48N16O24S4.4Na |
| Molecular Weight | 1429.185 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
| Stereo Comments | MESO |
SHOW SMILES / InChI
SMILES
[Na+].[Na+].[Na+].[Na+].[O-]S(=O)(=O)CCOC1=CC=C(OCCS([O-])(=O)=O)C2=C1CN3C4C5N(CN6C7C8N(CN9C%10C%11N(CN%12C%13C%14N(CC%15=C(CN%14C(=O)N%13CN%11C(=O)N%10CN8C(=O)N7CN5C(=O)N4C2)C(OCCS([O-])(=O)=O)=CC=C%15OCCS([O-])(=O)=O)C%12=O)C9=O)C6=O)C3=O
InChI
InChIKey=ANBVWYBXXMGNLI-UHFFFAOYSA-J
InChI=1S/C46H52N16O24S4.4Na/c63-39-47-13-23-24(28(84-6-10-88(74,75)76)2-1-27(23)83-5-9-87(71,72)73)14-48-31(47)33-51(39)17-55-35-37-59(43(55)67)21-61-38-36-57(45(61)69)19-53-34-32-49(41(53)65)15-25-26(30(86-8-12-90(80,81)82)4-3-29(25)85-7-11-89(77,78)79)16-50(32)42(66)54(34)20-58(36)46(70)62(38)22-60(37)44(68)56(35)18-52(33)40(48)64;;;;/h1-4,31-38H,5-22H2,(H,71,72,73)(H,74,75,76)(H,77,78,79)(H,80,81,82);;;;/q;4*+1/p-4
| Molecular Formula | C46H48N16O24S4 |
| Molecular Weight | 1337.226 |
| Charge | -4 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | Na |
| Molecular Weight | 22.98976928 |
| Charge | 1 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 17:23:44 GMT 2025
by
admin
on
Wed Apr 02 17:23:44 GMT 2025
|
| Record UNII |
8PN3QE2WE3
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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169490769
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8PN3QE2WE3
Created by
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