Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C31H36N2O8.H2O |
| Molecular Weight | 582.6414 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.COC(=O)[C@@H]1[C@@H](O)[C@@H](C[C@@H]2CN3CCC4=C(NC5=C4C=CC=C5)[C@H]3C[C@H]12)OC(=O)C6=CC(OC)=C(OC)C(OC)=C6
InChI
InChIKey=LLGVIGSLFVWBOJ-HZGKCDBDSA-N
InChI=1S/C31H36N2O8.H2O/c1-37-24-11-16(12-25(38-2)29(24)39-3)30(35)41-23-13-17-15-33-10-9-19-18-7-5-6-8-21(18)32-27(19)22(33)14-20(17)26(28(23)34)31(36)40-4;/h5-8,11-12,17,20,22-23,26,28,32,34H,9-10,13-15H2,1-4H3;1H2/t17-,20+,22-,23-,26+,28+;/m1./s1
Approval Year
| Name | Type | Language | ||
|---|---|---|---|---|
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Preferred Name | English | ||
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Common Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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6105-85-7
Created by
admin on Mon Mar 31 22:45:49 GMT 2025 , Edited by admin on Mon Mar 31 22:45:49 GMT 2025
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PRIMARY | |||
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91617667
Created by
admin on Mon Mar 31 22:45:49 GMT 2025 , Edited by admin on Mon Mar 31 22:45:49 GMT 2025
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PRIMARY | |||
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ADC3TWU42R
Created by
admin on Mon Mar 31 22:45:49 GMT 2025 , Edited by admin on Mon Mar 31 22:45:49 GMT 2025
|
PRIMARY | |||
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DTXSID90976548
Created by
admin on Mon Mar 31 22:45:49 GMT 2025 , Edited by admin on Mon Mar 31 22:45:49 GMT 2025
|
PRIMARY | |||
|
m450
Created by
admin on Mon Mar 31 22:45:49 GMT 2025 , Edited by admin on Mon Mar 31 22:45:49 GMT 2025
|
PRIMARY | Merck Index |
SUBSTANCE RECORD
