Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C74H86N7O27S4.7Na |
Molecular Weight | 1794.694 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 3 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].CC1(C)C(=CC=C2CCCC(C=CC3=[N+](CCCCS([O-])(=O)=O)C4=CC=C(C=C4C3(C)C)S([O-])(=O)=O)=C2OC5=CC=C(C[C@H](NC(=O)[C@H](CC6=CC=CC=C6)NC(=O)CCOCCOCCNC(=O)CC[C@H](NC(=O)N[C@@H](CCC([O-])=O)C([O-])=O)C([O-])=O)C([O-])=O)C=C5)N(CCCCS([O-])(=O)=O)C7=CC=C(C=C17)S([O-])(=O)=O
InChI
InChIKey=ZVQNOBGMXDIMLW-HHKHVMTFSA-G
InChI=1S/C74H93N7O27S4.7Na/c1-73(2)54-45-52(111(100,101)102)23-27-60(54)80(35-8-10-41-109(94,95)96)62(73)29-19-49-15-12-16-50(20-30-63-74(3,4)55-46-53(112(103,104)105)24-28-61(55)81(63)36-9-11-42-110(97,98)99)67(49)108-51-21-17-48(18-22-51)44-59(71(91)92)77-68(86)58(43-47-13-6-5-7-14-47)76-65(83)33-37-106-39-40-107-38-34-75-64(82)31-25-56(69(87)88)78-72(93)79-57(70(89)90)26-32-66(84)85;;;;;;;/h5-7,13-14,17-24,27-30,45-46,56-59H,8-12,15-16,25-26,31-44H2,1-4H3,(H12-,75,76,77,78,79,82,83,84,85,86,87,88,89,90,91,92,93,94,95,96,97,98,99,100,101,102,103,104,105);;;;;;;/q;7*+1/p-7/t56-,57-,58-,59-;;;;;;;/m0......./s1
Molecular Formula | C74H86N7O27S4 |
Molecular Weight | 1633.765 |
Charge | -7 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 3 |
Optical Activity | UNSPECIFIED |
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 |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 19:50:51 GMT 2023
by
admin
on
Sat Dec 16 19:50:51 GMT 2023
|
Record UNII |
QM8G3PQU2E
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Record Status |
Validated (UNII)
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Record Version |
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-
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2206660-95-7
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LM-66
Created by
admin on Sat Dec 16 19:50:51 GMT 2023 , Edited by admin on Sat Dec 16 19:50:51 GMT 2023
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QM8G3PQU2E
Created by
admin on Sat Dec 16 19:50:51 GMT 2023 , Edited by admin on Sat Dec 16 19:50:51 GMT 2023
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PRIMARY |