Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C73H126N12O31PS.Na |
Molecular Weight | 1753.872 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 21 / 21 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].CO[C@@H]1[C@H](O)[C@@H](COP([O-])(=S)OCCCCCCNC(=O)CCCCCNC(=O)[C@H](CCCCNC(=O)CCCCO[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2NC(C)=O)NC(=O)[C@H](CCCCNC(=O)CCCCO[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3NC(C)=O)NC(=O)CCCCO[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4NC(C)=O)O[C@H]1N5C=CC(N)=NC5=O
InChI
InChIKey=AVCSHIPVMFPKTH-MTLJDUNASA-M
InChI=1S/C73H127N12O31PS.Na/c1-42(89)79-56-63(100)59(96)47(38-86)114-70(56)108-34-19-11-25-53(93)76-30-16-9-22-45(67(103)78-32-15-7-8-24-52(92)75-29-14-5-6-18-37-111-117(106,118)112-41-50-62(99)66(107-4)69(113-50)85-33-28-51(74)84-73(85)105)83-68(104)46(82-55(95)27-13-21-36-110-72-58(81-44(3)91)65(102)61(98)49(40-88)116-72)23-10-17-31-77-54(94)26-12-20-35-109-71-57(80-43(2)90)64(101)60(97)48(39-87)115-71;/h28,33,45-50,56-66,69-72,86-88,96-102H,5-27,29-32,34-41H2,1-4H3,(H,75,92)(H,76,93)(H,77,94)(H,78,103)(H,79,89)(H,80,90)(H,81,91)(H,82,95)(H,83,104)(H,106,118)(H2,74,84,105);/q;+1/p-1/t45-,46-,47+,48+,49+,50+,56+,57+,58+,59-,60-,61-,62+,63+,64+,65+,66+,69+,70+,71+,72+,117?;/m0./s1
Molecular Formula | C73H126N12O31PS |
Molecular Weight | 1730.882 |
Charge | -1 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 21 / 21 |
E/Z Centers | 0 |
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 18:21:03 GMT 2023
by
admin
on
Sat Dec 16 18:21:03 GMT 2023
|
Record UNII |
BZ637PY7BV
|
Record Status |
Validated (UNII)
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Record Version |
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-
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155884857
Created by
admin on Sat Dec 16 18:21:04 GMT 2023 , Edited by admin on Sat Dec 16 18:21:04 GMT 2023
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PRIMARY | |||
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BZ637PY7BV
Created by
admin on Sat Dec 16 18:21:04 GMT 2023 , Edited by admin on Sat Dec 16 18:21:04 GMT 2023
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PRIMARY |