Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C45H57NO14.C4H8O2 |
| Molecular Weight | 924.0375 |
| Optical Activity | ( - ) |
| Defined Stereocenters | 11 / 11 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CCOC(C)=O.[H][C@@]12C[C@H](OC)[C@@]3(C)C(=O)[C@H](OC)C4=C(C)[C@H](C[C@@](O)([C@@H](OC(=O)C5=CC=CC=C5)[C@]3([H])[C@@]1(CO2)OC(C)=O)C4(C)C)OC(=O)[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C6=CC=CC=C6
InChI
InChIKey=VZJOQUNAZAQBPV-JVXKREHESA-N
InChI=1S/C45H57NO14.C4H8O2/c1-24-28(57-39(51)33(48)32(26-17-13-11-14-18-26)46-40(52)60-41(3,4)5)22-45(53)37(58-38(50)27-19-15-12-16-20-27)35-43(8,36(49)34(55-10)31(24)42(45,6)7)29(54-9)21-30-44(35,23-56-30)59-25(2)47;1-3-6-4(2)5/h11-20,28-30,32-35,37,48,53H,21-23H2,1-10H3,(H,46,52);3H2,1-2H3/t28-,29-,30+,32-,33+,34+,35-,37-,43+,44-,45+;/m0./s1
| Molecular Formula | C45H57NO14 |
| Molecular Weight | 835.9324 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 11 / 11 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | C4H8O2 |
| Molecular Weight | 88.1051 |
| Charge | 0 |
| 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 18:50:35 UTC 2023
by
admin
on
Sat Dec 16 18:50:35 UTC 2023
|
| Record UNII |
2HQG2N4L58
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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| Code System | Code | Type | Description | ||
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162623672
Created by
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100000183720
Created by
admin on Sat Dec 16 18:50:35 UTC 2023 , Edited by admin on Sat Dec 16 18:50:35 UTC 2023
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1438897-79-0
Created by
admin on Sat Dec 16 18:50:35 UTC 2023 , Edited by admin on Sat Dec 16 18:50:35 UTC 2023
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2HQG2N4L58
Created by
admin on Sat Dec 16 18:50:35 UTC 2023 , Edited by admin on Sat Dec 16 18:50:35 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
ANHYDROUS->SOLVATE |
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