Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C46H80N2O13.H3O4P |
| Molecular Weight | 967.1282 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 19 / 19 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OP(O)(O)=O.[H][C@@]4(O[C@H]1[C@@H](CCN2C[C@@H](C)C[C@@H](C)C2)C[C@@H](C)C(=O)\C=C\C(C)=C\[C@H](CO[C@@H]3O[C@H](C)[C@@H](O)[C@@H](OC)[C@H]3OC)[C@@H](CC)OC(=O)C[C@@H](O)[C@@H]1C)O[C@H](C)[C@@H](O)[C@@H]([C@H]4O)N(C)C
InChI
InChIKey=NESIVXZOSKKUDP-ARVJLQODSA-N
InChI=1S/C46H80N2O13.H3O4P/c1-13-36-33(24-57-46-44(56-12)43(55-11)40(53)31(8)59-46)19-25(2)14-15-34(49)28(5)20-32(16-17-48-22-26(3)18-27(4)23-48)42(29(6)35(50)21-37(51)60-36)61-45-41(54)38(47(9)10)39(52)30(7)58-45;1-5(2,3)4/h14-15,19,26-33,35-36,38-46,50,52-54H,13,16-18,20-24H2,1-12H3;(H3,1,2,3,4)/b15-14+,25-19+;/t26-,27+,28-,29+,30-,31-,32+,33-,35-,36-,38+,39-,40-,41-,42-,43-,44-,45+,46-;/m1./s1
Approval Year
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Code | English | ||
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Code | English |
| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C261
Created by
admin on Fri Dec 15 15:33:41 UTC 2023 , Edited by admin on Fri Dec 15 15:33:41 UTC 2023
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| Code System | Code | Type | Description | ||
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EE-26
Created by
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100000181047
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5282522
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SUB194841
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DTXSID201019820
Created by
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SMH7U1S683
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admin on Fri Dec 15 15:33:41 UTC 2023 , Edited by admin on Fri Dec 15 15:33:41 UTC 2023
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C84214
Created by
admin on Fri Dec 15 15:33:41 UTC 2023 , Edited by admin on Fri Dec 15 15:33:41 UTC 2023
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CHEMBL1908333
Created by
admin on Fri Dec 15 15:33:41 UTC 2023 , Edited by admin on Fri Dec 15 15:33:41 UTC 2023
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SMH7U1S683
Created by
admin on Fri Dec 15 15:33:41 UTC 2023 , Edited by admin on Fri Dec 15 15:33:41 UTC 2023
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1294593
Created by
admin on Fri Dec 15 15:33:41 UTC 2023 , Edited by admin on Fri Dec 15 15:33:41 UTC 2023
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137330-13-3
Created by
admin on Fri Dec 15 15:33:41 UTC 2023 , Edited by admin on Fri Dec 15 15:33:41 UTC 2023
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DBSALT001661
Created by
admin on Fri Dec 15 15:33:41 UTC 2023 , Edited by admin on Fri Dec 15 15:33:41 UTC 2023
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PRIMARY |
ACTIVE MOIETY
SUBSTANCE RECORD