Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C29H28N2O6S.H2O |
| Molecular Weight | 550.623 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.[H][C@@]12[C@H](NC(=O)COC3=CC=CC=C3)C(=O)N1[C@@H](C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5)C(C)(C)[S@@+]2[O-]
InChI
InChIKey=ZFBGWXDZOYWZDI-RYMGLMLMSA-N
InChI=1S/C29H28N2O6S.H2O/c1-29(2)25(28(34)37-24(19-12-6-3-7-13-19)20-14-8-4-9-15-20)31-26(33)23(27(31)38(29)35)30-22(32)18-36-21-16-10-5-11-17-21;/h3-17,23-25,27H,18H2,1-2H3,(H,30,32);1H2/t23-,25+,27-,38-;/m1./s1
| Molecular Formula | C29H28N2O6S |
| Molecular Weight | 532.607 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | H2O |
| Molecular Weight | 18.0153 |
| 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 15:00:15 GMT 2023
by
admin
on
Sat Dec 16 15:00:15 GMT 2023
|
| Record UNII |
E7HL3LV2W4
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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Common Name | English |
| Code System | Code | Type | Description | ||
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134687591
Created by
admin on Sat Dec 16 15:00:16 GMT 2023 , Edited by admin on Sat Dec 16 15:00:16 GMT 2023
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PRIMARY | |||
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186099-10-5
Created by
admin on Sat Dec 16 15:00:16 GMT 2023 , Edited by admin on Sat Dec 16 15:00:16 GMT 2023
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PRIMARY | |||
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E7HL3LV2W4
Created by
admin on Sat Dec 16 15:00:16 GMT 2023 , Edited by admin on Sat Dec 16 15:00:16 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
ANHYDROUS->SOLVATE |
