Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C72H116O4 |
Molecular Weight | 1045.689 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 3 / 3 |
E/Z Centers | 9 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CCCCCCCCCCCCCCCC(=O)O[C@@H]1CC(C)=C(\C=C\C(C)=C\C=C\C(C)=C\C=C\C=C(C)\C=C\C=C(C)\C=C\[C@H]2C(C)=C[C@@H](CC2(C)C)OC(=O)CCCCCCCCCCCCCCC)C(C)(C)C1
InChI
InChIKey=YHGJHDJZIOYZIR-URPSFYETSA-N
InChI=1S/C72H116O4/c1-13-15-17-19-21-23-25-27-29-31-33-35-37-49-69(73)75-65-55-63(7)67(71(9,10)57-65)53-51-61(5)47-41-45-59(3)43-39-40-44-60(4)46-42-48-62(6)52-54-68-64(8)56-66(58-72(68,11)12)76-70(74)50-38-36-34-32-30-28-26-24-22-20-18-16-14-2/h39-48,51-55,65-67H,13-38,49-50,56-58H2,1-12H3/b40-39+,45-41+,46-42+,53-51+,54-52+,59-43+,60-44+,61-47+,62-48+/t65-,66+,67-/m0/s1
Approval Year
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C860
Created by
admin on Fri Dec 15 15:42:18 UTC 2023 , Edited by admin on Fri Dec 15 15:42:18 UTC 2023
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100000079351
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C042447
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1551
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V2W1791D7V
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CHEMBL2105817
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5281240
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208-916-4
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DTXSID101023901
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C66661
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547-17-1
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SUB00098MIG
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admin on Fri Dec 15 15:42:18 UTC 2023 , Edited by admin on Fri Dec 15 15:42:18 UTC 2023
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ACTIVE MOIETY