Cas no 101144-24-5 (a-D-Glucopyranoside, methyl4-deoxy-4-[[(1R,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)-2-cyclohexen-1-yl]amino]-)
101144-24-5 structure
Product Name:a-D-Glucopyranoside, methyl4-deoxy-4-[[(1R,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)-2-cyclohexen-1-yl]amino]-
CAS No:101144-24-5
MF:C14H25NO9
MW:351.349605321884
CID:199742
PubChem ID:127767
Update Time:2025-04-19
a-D-Glucopyranoside, methyl4-deoxy-4-[[(1R,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)-2-cyclohexen-1-yl]amino]- Chemical and Physical Properties
Names and Identifiers
-
- a-D-Glucopyranoside, methyl4-deoxy-4-[[(1R,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)-2-cyclohexen-1-yl]amino]-
- (1S,2S,3R,6R)-6-[[(2S,3S,4S,5R,6S)-4,5-dihydroxy-2-(hydroxymethyl)-6-methoxyoxan-3-yl]amino]-4-(hydroxymethyl)cyclohex-4-ene-1,2,3-triol
- 6-hydroxy-methyl 1'-epiacarviosin
- 6-Hmecv
- alpha-D-Glucopyranoside, methyl 4-deoxy-4-((4,5,6-trihydroxy-3-(hydroxymethyl)-2-cyclohexen-1-yl)amino)-, (1R-(1alpha,4beta,5alpha,6beta))-
- methyl 4-deoxy-4-{[(1R,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}-alpha-D-glucopyranoside
- DTXSID70143751
- 6-Hydroxy-methyl 1/'-epiacarviosin
- SCHEMBL5158177
- 101144-24-5
-
- Inchi: 1S/C14H25NO9/c1-23-14-13(22)11(20)8(7(4-17)24-14)15-6-2-5(3-16)9(18)12(21)10(6)19/h2,6-22H,3-4H2,1H3/t6-,7-,8-,9-,10+,11+,12+,13-,14+/m1/s1
- InChI Key: UQSNMDDZJRJJQN-PEQZYJMFSA-N
- SMILES: O1[C@@H]([C@@H]([C@H]([C@@H]([C@H]1CO)N[C@@H]1C=C(CO)[C@H]([C@@H]([C@H]1O)O)O)O)O)OC
Computed Properties
- Exact Mass: 351.152931g/mol
- Monoisotopic Mass: 351.152931g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 8
- Hydrogen Bond Acceptor Count: 10
- Heavy Atom Count: 24
- Rotatable Bond Count: 5
- Complexity: 448
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 9
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Molecular Weight: 351.35g/mol
- XLogP3: -4.2
- Topological Polar Surface Area: 172?2
a-D-Glucopyranoside, methyl4-deoxy-4-[[(1R,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)-2-cyclohexen-1-yl]amino]- Related Literature
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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