Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | 2C14H14O3.C4H10N2 |
| Molecular Weight | 546.6539 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
C1CNCCN1.COC2=CC3=CC=C(C=C3C=C2)[C@H](C)C(O)=O.COC4=CC5=CC=C(C=C5C=C4)[C@H](C)C(O)=O
InChI
InChIKey=KRDCGZGYWRCHNN-NAWJVIAPSA-N
InChI=1S/2C14H14O3.C4H10N2/c2*1-9(14(15)16)10-3-4-12-8-13(17-2)6-5-11(12)7-10;1-2-6-4-3-5-1/h2*3-9H,1-2H3,(H,15,16);5-6H,1-4H2/t2*9-;/m00./s1
| Molecular Formula | C4H10N2 |
| Molecular Weight | 86.1356 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C14H14O3 |
| Molecular Weight | 230.2592 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 16:59:04 UTC 2023
by
admin
on
Fri Dec 15 16:59:04 UTC 2023
|
| Record UNII |
R2A8B8HIPI
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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70981-66-7
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76968825
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m7769
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admin on Fri Dec 15 16:59:04 UTC 2023 , Edited by admin on Fri Dec 15 16:59:04 UTC 2023
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DTXSID40221212
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275-083-1
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R2A8B8HIPI
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100000079686
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SUB14897MIG
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C504545
Created by
admin on Fri Dec 15 16:59:04 UTC 2023 , Edited by admin on Fri Dec 15 16:59:04 UTC 2023
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ACTIVE MOIETY |