Details
Stereochemistry | ABSOLUTE |
Molecular Formula | 2C48H63N5O9.3H2O4S |
Molecular Weight | 2002.319 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 18 / 18 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OS(O)(=O)=O.OS(O)(=O)=O.OS(O)(=O)=O.[H][C@@]12N3CC[C@@]14C5=CC(=C(OC)C=C5N(C)[C@@]4([H])[C@](O)([C@H](OC(=O)CN(C)C)[C@]2(CC)C=CC3)C(=O)OC)[C@]6(C[C@H]7CN(C[C@](O)(CC)C7)CCC8=C6NC9=C8C=CC=C9)C(=O)OC.[H][C@@]%10%11N%12CC[C@@]%10%13C%14=CC(=C(OC)C=C%14N(C)[C@@]%13([H])[C@](O)([C@H](OC(=O)CN(C)C)[C@]%11(CC)C=CC%12)C(=O)OC)[C@]%15(C[C@H]%16CN(C[C@](O)(CC)C%16)CCC%17=C%15NC%18=C%17C=CC=C%18)C(=O)OC
InChI
InChIKey=DVPVGSLIUJPOCJ-XXRQFBABSA-N
InChI=1S/2C48H63N5O9.3H2O4S/c2*1-9-44(57)24-29-25-47(42(55)60-7,38-31(16-20-52(26-29)28-44)30-14-11-12-15-34(30)49-38)33-22-32-35(23-36(33)59-6)51(5)40-46(32)18-21-53-19-13-17-45(10-2,39(46)53)41(48(40,58)43(56)61-8)62-37(54)27-50(3)4;3*1-5(2,3)4/h2*11-15,17,22-23,29,39-41,49,57-58H,9-10,16,18-21,24-28H2,1-8H3;3*(H2,1,2,3,4)/t2*29-,39-,40+,41+,44-,45+,46+,47-,48-;;;/m00.../s1
Approval Year
Name | Type | Language | ||
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Official Name | English | ||
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Common Name | English | ||
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Common Name | English | ||
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Common Name | English |
Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C932
Created by
admin on Fri Dec 15 15:03:00 UTC 2023 , Edited by admin on Fri Dec 15 15:03:00 UTC 2023
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Code System | Code | Type | Description | ||
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91617800
Created by
admin on Fri Dec 15 15:03:00 UTC 2023 , Edited by admin on Fri Dec 15 15:03:00 UTC 2023
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PRIMARY | |||
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70674-89-4
Created by
admin on Fri Dec 15 15:03:00 UTC 2023 , Edited by admin on Fri Dec 15 15:03:00 UTC 2023
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NON-SPECIFIC STOICHIOMETRY | |||
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7281-31-4
Created by
admin on Fri Dec 15 15:03:00 UTC 2023 , Edited by admin on Fri Dec 15 15:03:00 UTC 2023
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PRIMARY | |||
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X1J761618A
Created by
admin on Fri Dec 15 15:03:00 UTC 2023 , Edited by admin on Fri Dec 15 15:03:00 UTC 2023
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PRIMARY | |||
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CHEMBL2110749
Created by
admin on Fri Dec 15 15:03:00 UTC 2023 , Edited by admin on Fri Dec 15 15:03:00 UTC 2023
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PRIMARY | |||
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C95241
Created by
admin on Fri Dec 15 15:03:00 UTC 2023 , Edited by admin on Fri Dec 15 15:03:00 UTC 2023
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PRIMARY |
ACTIVE MOIETY
SUBSTANCE RECORD