Details
Stereochemistry | ACHIRAL |
Molecular Formula | C69H92Cl2N18O13 |
Molecular Weight | 1452.488 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 10 / 10 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)C[C@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@H](CO)NC(=O)[C@H](N)CC2=CNC3=CC=CC=C23)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N4CCC[C@H]4C(=O)N[C@H](C)C(=O)NC(=O)[C@@H](CC5=CC=C(Cl)C=C5)NC(=O)[C@@H](CC6=CC=C(Cl)C=C6)NC(C)=O
InChI
InChIKey=HDKMSGKLRVZCOD-SXMMSQOJSA-N
InChI=1S/C69H92Cl2N18O13/c1-37(2)30-52(84-60(95)50(12-7-27-77-68(73)74)82-63(98)54(33-42-19-25-46(92)26-20-42)86-65(100)56(36-90)87-59(94)48(72)34-43-35-79-49-11-6-5-10-47(43)49)61(96)83-51(13-8-28-78-69(75)76)67(102)89-29-9-14-57(89)66(101)80-38(3)58(93)88-64(99)55(32-41-17-23-45(71)24-18-41)85-62(97)53(81-39(4)91)31-40-15-21-44(70)22-16-40/h5-6,10-11,15-26,35,37-38,48,50-57,79,90,92H,7-9,12-14,27-34,36,72H2,1-4H3,(H,80,101)(H,81,91)(H,82,98)(H,83,96)(H,84,95)(H,85,97)(H,86,100)(H,87,94)(H4,73,74,77)(H4,75,76,78)(H,88,93,99)/t38-,48-,50-,51+,52+,53-,54+,55-,56+,57+/m1/s1
Molecular Formula | C69H92Cl2N18O13 |
Molecular Weight | 1452.488 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 10 / 10 |
E/Z Centers | 2 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 18:54:59 GMT 2023
by
admin
on
Fri Dec 15 18:54:59 GMT 2023
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Record UNII |
AXE8H8VY6H
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Record Status |
Validated (UNII)
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Record Version |
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-
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25078109
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DTXSID10231222
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AXE8H8VY6H
Created by
admin on Fri Dec 15 18:54:59 GMT 2023 , Edited by admin on Fri Dec 15 18:54:59 GMT 2023
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