Details
Stereochemistry | ABSOLUTE |
Molecular Formula | 2C21H30O2.C4H6O4 |
Molecular Weight | 747.0114 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)CCC(O)=O.[H][C@@]12CCC(C)=C[C@@]1([H])C3=C(O)C=C(CCCCC)C=C3OC2(C)C.[H][C@@]45CCC(C)=C[C@@]4([H])C6=C(O)C=C(CCCCC)C=C6OC5(C)C
InChI
InChIKey=ZTNSQRHQTPQSCH-VKLRDTKISA-N
InChI=1S/2C21H30O2.C4H6O4/c2*1-5-6-7-8-15-12-18(22)20-16-11-14(2)9-10-17(16)21(3,4)23-19(20)13-15;5-3(6)1-2-4(7)8/h2*11-13,16-17,22H,5-10H2,1-4H3;1-2H2,(H,5,6)(H,7,8)/t2*16-,17-;/m11./s1
Molecular Formula | C21H30O2 |
Molecular Weight | 314.4617 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C4H6O4 |
Molecular Weight | 118.088 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 16:22:41 UTC 2023
by
admin
on
Fri Dec 15 16:22:41 UTC 2023
|
Record UNII |
M67MK6J9X0
|
Record Status |
Validated (UNII)
|
Record Version |
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-
Download
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Common Name | English |
Code System | Code | Type | Description | ||
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76967311
Created by
admin on Fri Dec 15 16:22:41 UTC 2023 , Edited by admin on Fri Dec 15 16:22:41 UTC 2023
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PRIMARY | |||
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M67MK6J9X0
Created by
admin on Fri Dec 15 16:22:41 UTC 2023 , Edited by admin on Fri Dec 15 16:22:41 UTC 2023
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PRIMARY |
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ACTIVE MOIETY |