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Catalog Number | ACM74243019 |
CAS Number | 74243-01-9 |
Synonyms | 7-Acetylintermedine |
Molecular Weight | 341.4 |
InChI | InChI=1S/C17H27NO6/c1-10(2)17(22,11(3)19)16(21)23-9-13-5-7-18-8-6-14(15(13)18)24-12(4)20/h5,10-11,14-15,19,22H,6-9H2,1-4H3/t11-,14-,15-,17+/m1/s1 |
InChI Key | RKDOFSJTBIDAHX-CYHLAULCSA-N |
Purity | 95%+ |
Complexity | 531 |
Covalently-Bonded Unit Count | 1 |
Defined Atom Stereocenter Count | 4 |
Exact Mass | 341.18383758 |
Heavy Atom Count | 24 |
Hydrogen Bond Acceptor Count | 7 |
Hydrogen Bond Donor Count | 2 |
Isomeric SMILES | C[C@H]([C@@](C(C)C)(C(=O)OCC1=CCN2[C@H]1[C@@H](CC2)OC(=O)C)O)O |
Monoisotopic Mass | 341.18383758 |
PhysicalState | Powder |
Rotatable Bond Count | 8 |
Topological Polar Surface Area | 96.3 Ų |
What is the chemical structure of 7-ACETYLLYCOPSAMINE?
(2S,3R)-2,3-Dihydroxy-2-(1-methylethyl)butanoic acid [(1R,7aβ)-1α-(acetyloxy)-2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl]methyl ester
What are some synonyms for 7-ACETYLLYCOPSAMINE?
Acetylintermedine, Intermedine 1-acetate, O7-Acetylintermedine, 7-O-Acetylintermedine, etc.
What is the molecular formula of 7-ACETYLLYCOPSAMINE?
C17H27NO6
What is the molecular weight of 7-ACETYLLYCOPSAMINE?
341.4
How is 7-ACETYLLYCOPSAMINE commonly used?
It is a constituent or metabolite of pyrrolizidine alkaloid comfrey consumed by humans and used for herbal medicine.
What is the CAS number of 7-ACETYLLYCOPSAMINE?
74243-01-9
What are the safety implications of 7-ACETYLLYCOPSAMINE?
RIDADR: 1544, HazardClass: 6.1(b), PackingGroup: III
What is the role of Acetylintermedine in the pyrrolizines?
Acetylintermedine is a member of pyrrolizines.
How is Acetylintermedine related to herbal medicine?
Acetylintermedine is a constituent of comfrey, a plant used in herbal medicine.
Why is it important to be aware of the usage and synthesis of 7-ACETYLLYCOPSAMINE?
It is important for understanding its potential effects when consumed by humans and for ensuring safe practices in herbal medicine.
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