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Chrysanthellin a | CAS Number: 73039-13-1

Catalog Number
ACM73039131
Product Name
Chrysanthellin a
Structure
CAS Number
73039-13-1
EC Number
277-245-7
IUPAC Name
[3-[5-[3,5-dihydroxy-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl] 5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,1
Synonyms
CHRYSANTHELLIN A;PENTASACCHARIDE OF ECHINOCYSTIC ACID;Olean-12-en-28-oic acid, 3-(beta-d-glucopyranosyloxy)-16-hydroxy-, O-6-deoxy-alpha-l-mannopyranosyl-(1->3)-O-beta-d-xylopyranosyl-(1->4)-O-6-deoxy-alpha-l-mannopyranosyl-(1->2)-alpha-d-xylopyranosyl e
Molecular Weight
1191.35
Exact Mass
1190.61000
Molecular Formula
C58H94O25
Melting Point
209-225ÂșC
Density
1.47g/cm3
Purity
96%
SMILES
CC1C(C(C(C(O1)OC2C(COC(C2O)OC3C(OC(C(C3O)O)OC4C(C(COC4OC(=O)C56CCC(CC5C7=CCC8C9(CCC(C(C9CCC8(C7(CC6O)C)C)(C)C)OC1C(C(C(C(O1)CO)O)O)O)C)(C)C)O)O)C)O)O)O)O
InChIKey
IBEZGTWSSFFKNB-UHFFFAOYSA-N
H-Bond Donor
14
H-Bond Acceptor
25
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Email:
Tel:1-201-478-8534
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Fax: 1-516-927-0118
Address: Suite 212, Waverly Plaza, 755 Waverly Avenue, Holtsville, NY 11742, USA