Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C63H111N11O12 |
Molecular Weight | 1214.6219 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 11 / 11 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
C\C=C\C[C@@H](C)C(=O)[C@@H]1N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C(=O)[C@@H](NC1=O)C(C)C)C(C)C
InChI
InChIKey=YJDYDFNKCBANTM-QCWCSKBGSA-N
InChI=1S/C63H111N11O12/c1-26-27-28-41(16)53(76)52-57(80)67-49(38(10)11)61(84)68(19)33-48(75)69(20)44(29-34(2)3)56(79)66-50(39(12)13)62(85)70(21)45(30-35(4)5)55(78)64-42(17)54(77)65-43(18)58(81)71(22)46(31-36(6)7)59(82)72(23)47(32-37(8)9)60(83)73(24)51(40(14)15)63(86)74(52)25/h26-27,34-47,49-52H,28-33H2,1-25H3,(H,64,78)(H,65,77)(H,66,79)(H,67,80)/b27-26+/t41-,42+,43-,44+,45+,46+,47+,49+,50+,51+,52+/m1/s1
Molecular Formula | C63H111N11O12 |
Molecular Weight | 1214.6219 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 11 / 11 |
E/Z Centers | 1 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 15:52:11 UTC 2023
by
admin
on
Sat Dec 16 15:52:11 UTC 2023
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Record UNII |
Q7ZP55KF3X
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Record Status |
Validated (UNII)
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Record Version |
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-
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NCI_THESAURUS |
C1744
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admin on Sat Dec 16 15:52:12 UTC 2023 , Edited by admin on Sat Dec 16 15:52:12 UTC 2023
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121584-18-7
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C1405
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SUB00018MIG
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100000079050
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Q7ZP55KF3X
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m11373
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7481
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Valspodar
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DB11869
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C070272
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5281884
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CHEMBL1086218
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MM-11
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DTXSID90873386
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