Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C38H72N2O12.2H2O |
| Molecular Weight | 785.015 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 18 / 18 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.[H][C@@]1(C[C@@](C)(OC)[C@@H](O)[C@H](C)O1)O[C@H]2[C@H](C)[C@@H](O[C@]3([H])O[C@H](C)C[C@@H]([C@H]3O)N(C)C)[C@](C)(O)C[C@@H](C)CN(C)[C@H](C)[C@@H](O)[C@](C)(O)[C@@H](CC)OC(=O)[C@@H]2C
InChI
InChIKey=SRMPHJKQVUDLQE-KUJJYQHYSA-N
InChI=1S/C38H72N2O12.2H2O/c1-15-27-38(10,46)31(42)24(6)40(13)19-20(2)17-36(8,45)33(52-35-29(41)26(39(11)12)16-21(3)48-35)22(4)30(23(5)34(44)50-27)51-28-18-37(9,47-14)32(43)25(7)49-28;;/h20-33,35,41-43,45-46H,15-19H2,1-14H3;2*1H2/t20-,21-,22+,23-,24-,25+,26+,27-,28+,29-,30+,31-,32+,33-,35+,36-,37-,38-;;/m1../s1
Approval Year
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C261
Created by
admin on Fri Dec 15 15:53:55 UTC 2023 , Edited by admin on Fri Dec 15 15:53:55 UTC 2023
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| Code System | Code | Type | Description | ||
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m2177
Created by
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PRIMARY | Merck Index | ||
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5FD1131I7S
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SUB20599
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100000089047
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CHEMBL529
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253155
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admin on Fri Dec 15 15:53:55 UTC 2023 , Edited by admin on Fri Dec 15 15:53:55 UTC 2023
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PRIMARY | RxNorm | ||
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DTXSID80922539
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3033819
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SUB16399MIG
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2955
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117772-70-0
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C76214
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DBSALT000882
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5FD1131I7S
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1046056
Created by
admin on Fri Dec 15 15:53:55 UTC 2023 , Edited by admin on Fri Dec 15 15:53:55 UTC 2023
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ACTIVE MOIETY
SUBSTANCE RECORD
