Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C82H86Cl2N8O29 |
| Molecular Weight | 1718.502 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 18 / 18 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CCCCCCCCCCC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@H](O[C@H]1OC2=C3OC4=CC=C(C[C@H]5NC(=O)[C@H](NC)C6=CC(OC7=CC(O)=C(Cl)C(=C7)[C@H](NC5=O)C(=O)N[C@@H]8C(C=C2OC9=CC=C(C=C9Cl)[C@@H](O)[C@@H]%10NC(=O)[C@H](NC8=O)C%11=CC=C(O)C(=C%11)C%12=C(O[C@H]%13O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]%13O)C=C(O)C=C%12[C@H](NC%10=O)C(O)=O)=C3)=C(O)C=C6)C=C4)C(O)=O
InChI
InChIKey=KFFFTRROFFANLL-PKPPEPSOSA-N
InChI=1S/C82H86Cl2N8O29/c1-3-4-5-6-7-8-9-10-11-55(98)87-64-67(101)69(103)72(80(113)114)121-81(64)120-71-52-26-37-27-53(71)117-49-21-16-36(24-44(49)83)65(99)63-78(110)91-62(79(111)112)42-28-38(94)29-51(118-82-70(104)68(102)66(100)54(32-93)119-82)56(42)41-23-34(14-19-46(41)95)59(75(107)92-63)88-76(108)60(37)89-77(109)61-43-30-40(31-48(97)57(43)84)116-50-25-35(15-20-47(50)96)58(85-2)74(106)86-45(73(105)90-61)22-33-12-17-39(115-52)18-13-33/h12-21,23-31,45,54,58-70,72,81-82,85,93-97,99-104H,3-11,22,32H2,1-2H3,(H,86,106)(H,87,98)(H,88,108)(H,89,109)(H,90,105)(H,91,110)(H,92,107)(H,111,112)(H,113,114)/t45-,54-,58-,59-,60-,61+,62+,63+,64-,65-,66-,67-,68+,69+,70+,72+,81-,82+/m1/s1
| Molecular Formula | C82H86Cl2N8O29 |
| Molecular Weight | 1718.502 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 18 / 18 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 22:13:03 GMT 2025
by
admin
on
Mon Mar 31 22:13:03 GMT 2025
|
| Record UNII |
4E60GZ933I
|
| Record Status |
Validated (UNII)
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| Record Version |
|
-
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110882-83-2
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17748712
Created by
admin on Mon Mar 31 22:13:03 GMT 2025 , Edited by admin on Mon Mar 31 22:13:03 GMT 2025
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4E60GZ933I
Created by
admin on Mon Mar 31 22:13:03 GMT 2025 , Edited by admin on Mon Mar 31 22:13:03 GMT 2025
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PRIMARY |