Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C34H48O7.2Na |
| Molecular Weight | 614.7203 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 9 / 9 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[Na+].[H][C@@]12C[C@](C)(CC[C@]1(C)CC[C@]3(C)C2=CC(=O)[C@]4([H])[C@@]5(C)CC[C@H](OC(=O)CCC([O-])=O)C(C)(C)[C@]5([H])CC[C@@]34C)C([O-])=O
InChI
InChIKey=BQENDLAVTKRQMS-SBBGFIFASA-L
InChI=1S/C34H50O7.2Na/c1-29(2)23-10-13-34(7)27(32(23,5)12-11-24(29)41-26(38)9-8-25(36)37)22(35)18-20-21-19-31(4,28(39)40)15-14-30(21,3)16-17-33(20,34)6;;/h18,21,23-24,27H,8-17,19H2,1-7H3,(H,36,37)(H,39,40);;/q;2*+1/p-2/t21-,23-,24-,27+,30+,31-,32-,33+,34+;;/m0../s1
Approval Year
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C54678
Created by
admin on Fri Dec 15 15:09:27 UTC 2023 , Edited by admin on Fri Dec 15 15:09:27 UTC 2023
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| Code System | Code | Type | Description | ||
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SUB01042MIG
Created by
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231-044-0
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2018
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admin on Fri Dec 15 15:09:27 UTC 2023 , Edited by admin on Fri Dec 15 15:09:27 UTC 2023
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7421-40-1
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100000084870
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DTXSID7045572
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758146
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DBSALT001875
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F1MP7242Z5
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m3064
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admin on Fri Dec 15 15:09:27 UTC 2023 , Edited by admin on Fri Dec 15 15:09:27 UTC 2023
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F1MP7242Z5
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C82597
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CHEMBL499915
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636402
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ACTIVE MOIETY
SUBSTANCE RECORD
