Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C42H69O11.Na |
Molecular Weight | 772.9804 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 18 / 18 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[H][C@@]1(CC[C@H](C)[C@@]([H])(O1)[C@@H](C)[C@H](O)[C@H](C)C(=O)[C@H](CC)[C@@]2([H])O[C@@]3(O[C@@]4(CC[C@](C)(O4)[C@@]5([H])CC[C@](O)(CC)[C@H](C)O5)[C@H](O)C=C3)[C@H](C)C[C@@H]2C)[C@@H](CC)C([O-])=O
InChI
InChIKey=YPZYGIQXBGHDBH-UZHRAPRISA-M
InChI=1S/C42H70O11.Na/c1-11-29(38(46)47)31-15-14-23(4)36(50-31)27(8)34(44)26(7)35(45)30(12-2)37-24(5)22-25(6)41(51-37)19-16-32(43)42(53-41)21-20-39(10,52-42)33-17-18-40(48,13-3)28(9)49-33;/h16,19,23-34,36-37,43-44,48H,11-15,17-18,20-22H2,1-10H3,(H,46,47);/q;+1/p-1/t23-,24-,25+,26-,27-,28-,29+,30-,31+,32+,33+,34+,36+,37-,39-,40+,41-,42-;/m0./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 | C42H69O11 |
Molecular Weight | 749.9907 |
Charge | -1 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 18 / 18 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:35:58 UTC 2023
by
admin
on
Fri Dec 15 15:35:58 UTC 2023
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Record UNII |
92UOD3BMEK
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Record Status |
Validated (UNII)
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Record Version |
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-
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23703990
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55721-31-8
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1812261
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751548
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92UOD3BMEK
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m9743
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admin on Fri Dec 15 15:35:58 UTC 2023 , Edited by admin on Fri Dec 15 15:35:58 UTC 2023
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92UOD3BMEK
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DBSALT001701
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DTXSID1045902
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |