Lanatoside C
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Lanatoside C
structure -
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CAS No:
17575-22-3
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Formula:
C49H76O20
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Chemical Name:
Lanatoside C
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Synonyms:
Card-20(22)-enolide,3-[(O-β-D-glucopyranosyl-(1→4)-O-3-O-acetyl-2,6-dideoxy-β-D-ribo-hexopyranosyl-(1→4)-O-2,6-dideoxy-β-D-ribo-hexopyranosyl-(1→4)-2,6-dideoxy-β-D-ribo-hexopyranosyl)oxy]-12,14-dihydroxy-,(3β,5β,12β)-;Lanatoside C;(3β,5β,12β)-3-[(O-β-D-Glucopyranosyl-(1→4)-O-3-O-acetyl-2,6-dideoxy-β-D-ribo-hexopyranosyl-(1→4)-O-2,6-dideoxy-β-D-ribo-hexopyranosyl-(1→4)-2,6-dideoxy-β-D-ribo-hexopyranosyl)oxy]-12,14-dihydroxycard-20(22)-enolide;Cedilanid;Digilanide C;Isolanid;Isolanide;Ceglunate;Celadigal;Lanimerck;Cetosanol;Allocor;Ceglunat;Celanid;Celanide;Lanatigen C;Digilanogen C;NSC 119991;NSC 7533;Digilanid C;35-86-9;11019-78-6;37267-71-3
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CAS No:
Characteristics
288.28000
0.61310
1.42±0.1 g/cm3 (20 ºC 760 Torr)
272-274°C
741.7°C (rough estimate)
1.7630 (estimate)
−20°C
D20 +33.4 to +33.7° (200 mg dry weight in 10 ml alcohol)
Safety Information
UN 2811 6.1/PG 2
3
23/24/25
36/37/39-45
OE2100000
T
P261-P280-P301 + P310-P311
H301-H311-H331
|Danger|H301 (95.35%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P311, P312, P321, P322, P330, P361, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 43 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:985.1
XLogP3:0.2
Hydrogen Bond Donor Count:8
Hydrogen Bond Acceptor Count:20
Rotatable Bond Count:12
Exact Mass:984.49299481
Monoisotopic Mass:984.49299481
Topological Polar Surface Area:288
Heavy Atom Count:69
Complexity:1870
Undefined Atom Stereocenter Count:26
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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