Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C27H31NO11S |
| Molecular Weight | 577.6 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=C(OC)C2=C(CC[C@H](NC(C)=O)C3=CC(=O)C(SC)=CC=C23)C=C1O[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)C(O)=O
InChI
InChIKey=JJEHAQVFBUIDIV-BVLXLYFTSA-N
InChI=1S/C27H31NO11S/c1-11(29)28-15-7-5-12-9-17(38-27-22(33)20(31)21(32)25(39-27)26(34)35)23(36-2)24(37-3)19(12)13-6-8-18(40-4)16(30)10-14(13)15/h6,8-10,15,20-22,25,27,31-33H,5,7H2,1-4H3,(H,28,29)(H,34,35)/t15-,20-,21-,22+,25-,27+/m0/s1
| Molecular Formula | C27H31NO11S |
| Molecular Weight | 577.6 |
| 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
Sat Dec 16 15:25:04 GMT 2023
by
admin
on
Sat Dec 16 15:25:04 GMT 2023
|
| Record UNII |
05G7L63OGQ
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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05G7L63OGQ
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9916212
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819802-34-1
Created by
admin on Sat Dec 16 15:25:04 GMT 2023 , Edited by admin on Sat Dec 16 15:25:04 GMT 2023
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DTXSID50747478
Created by
admin on Sat Dec 16 15:25:04 GMT 2023 , Edited by admin on Sat Dec 16 15:25:04 GMT 2023
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| Related Record | Type | Details | ||
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PARENT -> METABOLITE ACTIVE |
