Cas no 24915-65-9 (b-D-Glucopyranoside, (3b,22a,25S)-22,25-epoxy-26-(b-D-glucopyranosyloxy)furost-5-en-3-yl O-6-deoxy-a-L-mannopyranosyl-(1®4)-O-[b-D-glucopyranosyl-(1®2)]-)
24915-65-9 structure
Product Name:b-D-Glucopyranoside, (3b,22a,25S)-22,25-epoxy-26-(b-D-glucopyranosyloxy)furost-5-en-3-yl O-6-deoxy-a-L-mannopyranosyl-(1®4)-O-[b-D-glucopyranosyl-(1®2)]-
CAS No:24915-65-9
MF:C51H82O23
MW:1063.18299913406
CID:269194
PubChem ID:267363
Update Time:2025-04-19
b-D-Glucopyranoside, (3b,22a,25S)-22,25-epoxy-26-(b-D-glucopyranosyloxy)furost-5-en-3-yl O-6-deoxy-a-L-mannopyranosyl-(1®4)-O-[b-D-glucopyranosyl-(1®2)]- Chemical and Physical Properties
Names and Identifiers
-
- b-D-Glucopyranoside, (3b,22a,25S)-22,25-epoxy-26-(b-D-glucopyranosyloxy)furost-5-en-3-yl O-6-deoxy-a-L-mannopyranosyl-(1®
- Avenacoside A
- NSC-106556
- NSC106556
- 3-{[6-Deoxyhexopyranosyl-(1->4)-[hexopyranosyl-(1->2)]hexopyranosyl]oxy}-22,25-epoxyfurost-5-en-27-yl hexopyranoside
- Avenacosid A
- 2-[4-hydroxy-2-(hydroxymethyl)-6-[5',7,9,13-tetramethyl-5'-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]spiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxolane]-16-yl]oxy-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol
- 24915-65-9
- DTXSID60947801
- AVENACOSIDEA
- β-D-Glucopyranoside, (3β,22α,25S)-22,25-epoxy-26-(β-D-glucopyranosyloxy)furost-5-en-3-yl O-6-deoxy-α-L-mannopyranosyl-(1→4)-O-[β-D-glucopyranosyl-(1→2)]-
- Avenacoside A >=95% (LC/MS-ELSD)
- b-D-Glucopyranoside, (3b,22a,25S)-22,25-epoxy-26-(b-D-glucopyranosyloxy)furost-5-en-3-yl O-6-deoxy-a-L-mannopyranosyl-(1®4)-O-[b-D-glucopyranosyl-(1®2)]-
-
- Inchi: 1S/C51H82O23/c1-20-31-27(73-51(20)13-12-48(3,74-51)19-65-44-38(61)36(59)33(56)28(16-52)68-44)15-26-24-7-6-22-14-23(8-10-49(22,4)25(24)9-11-50(26,31)5)67-47-43(72-46-40(63)37(60)34(57)29(17-53)69-46)41(64)42(30(18-54)70-47)71-45-39(62)35(58)32(55)21(2)66-45/h6,20-21,23-47,52-64H,7-19H2,1-5H3
- InChI Key: AAJHVVLGKCKBSH-UHFFFAOYSA-N
- SMILES: O1C2(CCC(C)(COC3C(C(C(C(CO)O3)O)O)O)O2)C(C)C2C1CC1C3CC=C4CC(CCC4(C)C3CCC12C)OC1C(C(C(C(CO)O1)OC1C(C(C(C(C)O1)O)O)O)O)OC1C(C(C(C(CO)O1)O)O)O
Computed Properties
- Exact Mass: 1062.52000
- Monoisotopic Mass: 1062.525
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 13
- Hydrogen Bond Acceptor Count: 23
- Heavy Atom Count: 74
- Rotatable Bond Count: 12
- Complexity: 1990
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 31
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 355A^2
- XLogP3: -2
Experimental Properties
- Density: 1.51
- Boiling Point: °Cat760mmHg
- Flash Point: °C
- Refractive Index: 1.645
- PSA: 355.29000
- LogP: -2.84680
- pka: 12?+-.0.70(Predicted)
b-D-Glucopyranoside, (3b,22a,25S)-22,25-epoxy-26-(b-D-glucopyranosyloxy)furost-5-en-3-yl O-6-deoxy-a-L-mannopyranosyl-(1®4)-O-[b-D-glucopyranosyl-(1®2)]- Security Information
- WGK Germany:3
- Storage Condition:?20°C
b-D-Glucopyranoside, (3b,22a,25S)-22,25-epoxy-26-(b-D-glucopyranosyloxy)furost-5-en-3-yl O-6-deoxy-a-L-mannopyranosyl-(1®4)-O-[b-D-glucopyranosyl-(1®2)]- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| XI GE MA AO DE LI QI ( SHANG HAI ) MAO YI Co., Ltd. | SMB00251-1MG |
Avenacoside A |
24915-65-9 | 1mg |
¥3955.23 | 2023-09-14 |
b-D-Glucopyranoside, (3b,22a,25S)-22,25-epoxy-26-(b-D-glucopyranosyloxy)furost-5-en-3-yl O-6-deoxy-a-L-mannopyranosyl-(1®4)-O-[b-D-glucopyranosyl-(1®2)]- Related Literature
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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