Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C20H31NO2S.C6H8O7 |
| Molecular Weight | 541.654 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)CC(O)(CC(O)=O)C(O)=O.O=C(OCCN1CCCCCC1)[C@@H](C2CCCCC2)C3=CSC=C3
InChI
InChIKey=XMGJGSKRRWXOIF-FYZYNONXSA-N
InChI=1S/C20H31NO2S.C6H8O7/c22-20(23-14-13-21-11-6-1-2-7-12-21)19(18-10-15-24-16-18)17-8-4-3-5-9-17;7-3(8)1-6(13,5(11)12)2-4(9)10/h10,15-17,19H,1-9,11-14H2;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/t19-;/m0./s1
Approval Year
| Name | Type | Language | ||
|---|---|---|---|---|
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Common Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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BNV040JCIA
Created by
admin on Sat Dec 16 02:16:54 GMT 2023 , Edited by admin on Sat Dec 16 02:16:54 GMT 2023
|
PRIMARY | |||
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76966889
Created by
admin on Sat Dec 16 02:16:54 GMT 2023 , Edited by admin on Sat Dec 16 02:16:54 GMT 2023
|
PRIMARY |
SUBSTANCE RECORD
