Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C35H31NO9.ClH |
Molecular Weight | 646.083 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.[H][C@@]12OC3=C(OC(=O)C4=C(OC(C)=O)C=CC=C4)C=CC5=C3[C@@]16CCN(C)[C@]([H])(C5)[C@]6([H])CC=C2OC(=O)C7=C(OC(C)=O)C=CC=C7
InChI
InChIKey=BQOLRGIWWHXAEF-MFWDCWMPSA-N
InChI=1S/C35H31NO9.ClH/c1-19(37)41-26-10-6-4-8-22(26)33(39)43-28-14-12-21-18-25-24-13-15-29(32-35(24,16-17-36(25)3)30(21)31(28)45-32)44-34(40)23-9-5-7-11-27(23)42-20(2)38;/h4-12,14-15,24-25,32H,13,16-18H2,1-3H3;1H/t24-,25+,32-,35-;/m0./s1
Molecular Formula | C35H31NO9 |
Molecular Weight | 609.6219 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | ClH |
Molecular Weight | 36.461 |
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 10:40:46 GMT 2023
by
admin
on
Sat Dec 16 10:40:46 GMT 2023
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Record UNII |
NA139C416X
|
Record Status |
Validated (UNII)
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Record Version |
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-
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Systematic Name | English |
Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C241
Created by
admin on Sat Dec 16 10:40:46 GMT 2023 , Edited by admin on Sat Dec 16 10:40:46 GMT 2023
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Code System | Code | Type | Description | ||
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C142934
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admin on Sat Dec 16 10:40:46 GMT 2023 , Edited by admin on Sat Dec 16 10:40:46 GMT 2023
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PRIMARY | |||
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100000183621
Created by
admin on Sat Dec 16 10:40:46 GMT 2023 , Edited by admin on Sat Dec 16 10:40:46 GMT 2023
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PRIMARY | |||
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EF-38
Created by
admin on Sat Dec 16 10:40:46 GMT 2023 , Edited by admin on Sat Dec 16 10:40:46 GMT 2023
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PRIMARY | |||
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131709261
Created by
admin on Sat Dec 16 10:40:46 GMT 2023 , Edited by admin on Sat Dec 16 10:40:46 GMT 2023
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PRIMARY | |||
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NA139C416X
Created by
admin on Sat Dec 16 10:40:46 GMT 2023 , Edited by admin on Sat Dec 16 10:40:46 GMT 2023
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PRIMARY | |||
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1431530-07-2
Created by
admin on Sat Dec 16 10:40:46 GMT 2023 , Edited by admin on Sat Dec 16 10:40:46 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |