Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C54H74N2O12 |
| Molecular Weight | 943.1716 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Charge | 2 |
SHOW SMILES / InChI
SMILES
COC1=C(OC)C=C(C[C@@H]2C3=CC(OC)=C(OC)C=C3CC[N@+]2(C)CCC(=O)OCCCCCCOC(=O)CC[N@@+]4(C)CCC5=CC(OC)=C(OC)C=C5[C@H]4CC6=CC(OC)=C(OC)C=C6)C=C1
InChI
InChIKey=TZXBZWGHRIFMCR-MJQWJGMHSA-N
InChI=1S/C54H74N2O12/c1-55(23-19-39-33-49(63-7)51(65-9)35-41(39)43(55)29-37-15-17-45(59-3)47(31-37)61-5)25-21-53(57)67-27-13-11-12-14-28-68-54(58)22-26-56(2)24-20-40-34-50(64-8)52(66-10)36-42(40)44(56)30-38-16-18-46(60-4)48(32-38)62-6/h15-18,31-36,43-44H,11-14,19-30H2,1-10H3/q+2/t43-,44-,55-,56-/m1/s1
| Molecular Formula | C54H74N2O12 |
| Molecular Weight | 943.1716 |
| Charge | 2 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 19:46:23 UTC 2023
by
admin
on
Sat Dec 16 19:46:23 UTC 2023
|
| Record UNII |
2THC2Z2PM2
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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2THC2Z2PM2
Created by
admin on Sat Dec 16 19:46:23 UTC 2023 , Edited by admin on Sat Dec 16 19:46:23 UTC 2023
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44251590
Created by
admin on Sat Dec 16 19:46:23 UTC 2023 , Edited by admin on Sat Dec 16 19:46:23 UTC 2023
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1193104-84-5
Created by
admin on Sat Dec 16 19:46:23 UTC 2023 , Edited by admin on Sat Dec 16 19:46:23 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> IMPURITY |
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