Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C23H30N2O4.C6H8O7 |
| Molecular Weight | 590.6188 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)CC(O)(CC(O)=O)C(O)=O.[H][C@@]12OC3=C4C(C[C@@]5([H])N(C)CC[C@@]14[C@@]5([H])C=C[C@@H]2O)=CC=C3OCCN6CCOCC6
InChI
InChIKey=YQRMJBKLKRYXSC-RNFKYSJUSA-N
InChI=1S/C23H30N2O4.C6H8O7/c1-24-7-6-23-16-3-4-18(26)22(23)29-21-19(5-2-15(20(21)23)14-17(16)24)28-13-10-25-8-11-27-12-9-25;7-3(8)1-6(13,5(11)12)2-4(9)10/h2-5,16-18,22,26H,6-14H2,1H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/t16-,17+,18-,22-,23-;/m0./s1
| Molecular Formula | C23H30N2O4 |
| Molecular Weight | 398.4953 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | C6H8O7 |
| Molecular Weight | 192.1235 |
| 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 10:48:11 UTC 2023
by
admin
on
Sat Dec 16 10:48:11 UTC 2023
|
| Record UNII |
K7Z9OPE11S
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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Common Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
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70545035
Created by
admin on Sat Dec 16 10:48:11 UTC 2023 , Edited by admin on Sat Dec 16 10:48:11 UTC 2023
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PRIMARY | |||
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14053-60-2
Created by
admin on Sat Dec 16 10:48:11 UTC 2023 , Edited by admin on Sat Dec 16 10:48:11 UTC 2023
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NON-SPECIFIC STEREOCHEMISTRY | |||
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K7Z9OPE11S
Created by
admin on Sat Dec 16 10:48:11 UTC 2023 , Edited by admin on Sat Dec 16 10:48:11 UTC 2023
|
PRIMARY |
| Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
| Related Record | Type | Details | ||
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ACTIVE MOIETY |