Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C45H55N9O6.2ClH |
| Molecular Weight | 890.897 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.Cl.C[C@@H](N)C(=O)N[C@H](CC1=CC2=CC=CC=C2C=C1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC3=CNC4=C3C=CC=C4)C(=O)N[C@H](CC5=CC=CC=C5)C(=O)N[C@@H](CCCCN)C(N)=O
InChI
InChIKey=ILOHMCCDCAUTQF-JESKXYQHSA-N
InChI=1S/C45H55N9O6.2ClH/c1-27(47)41(56)52-38(24-30-19-20-31-14-6-7-15-32(31)22-30)43(58)50-28(2)42(57)53-39(25-33-26-49-35-17-9-8-16-34(33)35)45(60)54-37(23-29-12-4-3-5-13-29)44(59)51-36(40(48)55)18-10-11-21-46;;/h3-9,12-17,19-20,22,26-28,36-39,49H,10-11,18,21,23-25,46-47H2,1-2H3,(H2,48,55)(H,50,58)(H,51,59)(H,52,56)(H,53,57)(H,54,60);2*1H/t27-,28+,36+,37-,38-,39+;;/m1../s1
| Molecular Formula | ClH |
| Molecular Weight | 36.461 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C45H55N9O6 |
| Molecular Weight | 817.9749 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:38:53 UTC 2023
by
admin
on
Fri Dec 15 15:38:53 UTC 2023
|
| Record UNII |
R4AVR27MM8
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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| Classification Tree | Code System | Code | ||
|---|---|---|---|---|
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NCI_THESAURUS |
C76358
Created by
admin on Fri Dec 15 15:38:53 UTC 2023 , Edited by admin on Fri Dec 15 15:38:53 UTC 2023
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FDA ORPHAN DRUG |
372912
Created by
admin on Fri Dec 15 15:38:53 UTC 2023 , Edited by admin on Fri Dec 15 15:38:53 UTC 2023
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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m9094
Created by
admin on Fri Dec 15 15:38:53 UTC 2023 , Edited by admin on Fri Dec 15 15:38:53 UTC 2023
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PRIMARY | Merck Index | ||
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HH-28
Created by
admin on Fri Dec 15 15:38:53 UTC 2023 , Edited by admin on Fri Dec 15 15:38:53 UTC 2023
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PRIMARY | |||
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158827-34-0
Created by
admin on Fri Dec 15 15:38:53 UTC 2023 , Edited by admin on Fri Dec 15 15:38:53 UTC 2023
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PRIMARY | |||
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CHEMBL106593
Created by
admin on Fri Dec 15 15:38:53 UTC 2023 , Edited by admin on Fri Dec 15 15:38:53 UTC 2023
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PRIMARY | |||
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C74356
Created by
admin on Fri Dec 15 15:38:53 UTC 2023 , Edited by admin on Fri Dec 15 15:38:53 UTC 2023
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PRIMARY | |||
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9940988
Created by
admin on Fri Dec 15 15:38:53 UTC 2023 , Edited by admin on Fri Dec 15 15:38:53 UTC 2023
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PRIMARY | |||
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R4AVR27MM8
Created by
admin on Fri Dec 15 15:38:53 UTC 2023 , Edited by admin on Fri Dec 15 15:38:53 UTC 2023
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PRIMARY | |||
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1492038
Created by
admin on Fri Dec 15 15:38:53 UTC 2023 , Edited by admin on Fri Dec 15 15:38:53 UTC 2023
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PRIMARY | RxNorm |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> SALT/SOLVATE |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
ACTIVE MOIETY |