Chemical Compound

(2S,2'S,3R,3'R,4R,4'R,5R,5'R,6S,6'S)-6,6'-(((2R,3S,4S,5R,6R)-4-Hydroxy-2-(Hydroxymethyl)-6-(((2'R,4S,5'R,6Ar,6Bs,8As,8Br,9S,11As,12As,12Bs)-5',6A,8A,9-Tetramethyl-1,3,4,5,6,6A,6B,7,8,8A,8B,9,11A,12,12A,12B-Hexadecahydrospiro[Naphtho[2',1':4,5]Indeno[2,1-B]Furan-10,2'-Piperidin]-4-Yl)Oxy)Tetrahydro-2H-Pyran-3,5-Diyl)Bis(Oxy))Bis(2-Methyltetrahydro-2H-Pyran-3,4,5-Triol)

CAS Registry Number 20311-51-7
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(2S,2'S,3R,3'R,4R,4'R,5R,5'R,6S,6'S)-6,6'-(((2R,3S,4S,5R,6R)-4-Hydroxy-2-(Hydroxymethyl)-6-(((2'R,4S,5'R,6Ar,6Bs,8As,8Br,9S,11As,12As,12Bs)-5',6A,8A,9-Tetramethyl-1,3,4,5,6,6A,6B,7,8,8A,8B,9,11A,12,12A,12B-Hexadecahydrospiro[Naphtho[2',1':4,5]Indeno[2,1-B]Furan-10,2'-Piperidin]-4-Yl)Oxy)Tetrahydro-2H-Pyran-3,5-Diyl)Bis(Oxy))Bis(2-Methyltetrahydro-2H-Pyran-3,4,5-Triol) 结构式
Primary record

(2S,2'S,3R,3'R,4R,4'R,5R,5'R,6S,6'S)-6,6'-(((2R,3S,4S,5R,6R)-4-Hydroxy-2-(Hydroxymethyl)-6-(((2'R,4S,5'R,6Ar,6Bs,8As,8Br,9S,11As,12As,12Bs)-5',6A,8A,9-Tetramethyl-1,3,4,5,6,6A,6B,7,8,8A,8B,9,11A,12,12A,12B-Hexadecahydrospiro[Naphtho[2',1':4,5]Indeno[2,1-B]Furan-10,2'-Piperidin]-4-Yl)Oxy)Tetrahydro-2H-Pyran-3,5-Diyl)Bis(Oxy))Bis(2-Methyltetrahydro-2H-Pyran-3,4,5-Triol)

库存
4,738 克
纯度
99.3 %
CAS
20311-51-7

化合物标识与属性

CAS
20311-51-7
PubChem CID
73611
SMILES
C[C@@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC=C6[C@@]5(CC[C@@H](C6)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O[C@H]8[C@@H]([C@@H]([C@H]([C@@H](O8)C)O)O)O)O)O[C@H]9[C@@H]([C@@H]([C@H]([C@@H](O9)C)O)O)O)C)C)C)NC1
Canonical SMILES
C[C@@H]1CC[C@@]2(NC1)O[C@H]1C[C@H]3[C@@H]4CC=C5C[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O[C@@H]7O[C@@H](C)[C@H](O)[C@@H](O)[C@H]7O)[C@H](O)[C@H]6O[C@@H]6O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C

名称与同义词

  • Solamargine
  • Solamargin
  • beta-Solamarine
  • a-Solamargine
  • Alpha-solamargine
  • |A-Solanigrine
  • 20311-51-7
  • Curaderm (TN)
  • Solanigrine, (-)-
  • SOLAMARIN, BETA
  • UNII-8KG991E7BN
  • 8KG991E7BN
  • DELTA-SOLANIGRINE
  • (-)-SOLAMARGINE
  • RefChem:184184
  • Solamargin;|A-Solanigrine
  • D07ORO
  • AC1L2K61
  • DTXSID00942456
  • MFCD30207844
  • C45H73NO15
  • CHEBI:9185
  • CHEMBL443114
  • orb1303274
  • NSC 407810
  • SCHEMBL27829541
  • Solasodine-L-rhamnosido-D-glucoside
  • DTXCID001514400
  • KST-1A2603
  • NSC-407810
  • CID73611
  • HY-N0069
  • AR-1A5009
  • MSK163965
  • NP0028
  • NSC 94735
  • NSC407810
  • s9145
  • AKOS030526705
  • C45-H73-N-O15
  • ZINC252474776
  • ACN-047178
  • CCG-270542
  • CS-4159
  • DB12700
  • EBC-615887
  • OS65545
  • BETA-SOLAMARINE (REFERENCE GRADE)
  • AS-75093
  • DA-57990
  • J15.529B
  • FT-0776091
  • N1375
  • NS00073646
  • C10819
  • A1201487
  • Q3489126
  • (2S,2'S,3R,3'R,4R,4'R,5R,5'R,6S,6'S)-6,6'-(((2R,3S,4S,5R,6R)-4-Hydroxy-2-(Hydroxymethyl)-6-(((2'R,4S,5'R,6Ar,6Bs,8As,8Br,9S,11As,12As,12Bs)-5',6A,8A,9-Tetramethyl-1,3,4,5,6,6A,6B,7,8,8A,8B,9,11A,12,12A,12B-Hexadecahydrospiro[Naphtho[2',1':4,5]Indeno[2,1-B]Furan-10,2'-Piperidin]-4-Yl)Oxy)Tetrahydro-2H-Pyran-3,5-Diyl)Bis(Oxy))Bis(2-Methyltetrahydro-2H-Pyran-3,4,5-Triol)
  • (2S,3R,4R,5R,6S)-2-[(2R,3S,4S,5R,6R)-4-hydroxy-2-(hydroxymethyl)-6-[(1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-piperidine]-16-yl]oxy-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol
  • (3|A,22|A,25r)-spirosol-5-en-3-yl 6-deoxy-|A-l-mannopyranosyl-(1->2)-[6-deoxy-|A-l-mannopyranosyl-(1->4)]-|A-d-glucopyranoside
  • 20737-42-2
  • 3671-38-3
  • beta-D-Glucopyranoside, (3beta,22alpha,25R)-spirosol-5-en-3-yl O-6-deoxy-alpha-L-mannopyranosyl-(1-2)-O-(6-deoxy-alpha-L-mannopyranosyl-(1-4))-
  • (1R)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxycyclopent-2-ene-1-carbonitrile
  • (25R)-22alpha-Spirosol-5-en-3beta-yl 6-deoxy-alpha-L-mannopyranosyl-(1->2)-[6-deoxy-alpha-L-mannopyranosyl-(1->4)]-beta-D-glucopyranoside
  • (2S,3R,4R,5R,6S)-2-((2R,3S,4S,5R,6R)-4-hydroxy-2-(hydroxymethyl)-6-((1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro(5-oxapentacyclo(10.8.0.02,9.04,8.013,18)icos-18-ene-6,2'-piperidine)-16-yl)oxy-5-((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-3-yl)oxy-6-methyloxane-3,4,5-triol
  • (2S,3R,4R,5R,6S)-2-[(2R,3S,4S,5R,6R)-4-hydroxy-2-(hydroxymethyl)-6-[(1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-piperidine]-16-yl]oxy-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-3-yl]oxy-6-methyl-tetrahydropyran-3,4,5-triol
  • (2S,3R,4R,5R,6S)-2-{[(2R,3R,4S,5S,6R)-4-hydroxy-6-(hydroxymethyl)-2-[(1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethyl-5-oxaspiro[pentacyclo[10.8.0.0(2),?.0?,?.0(1)(3),(1)?]icosane-6,2'-piperidin]-18-eneoxy]-5-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol
  • (2S,3R,4R,5R,6S)-2-{[(2R,3S,4S,5R,6R)-4-hydroxy-2-(hydroxymethyl)-6-[(1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethyl-5-oxaspiro[pentacyclo[10.8.0.0^{2,9}.0^{4,8}.0^{13,18}]icosane-6,2'-piperidin]-18-eneoxy]-5-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol
  • (2S,3R,4R,5R,6S)-2-{[(2R,3S,4S,5R,6R)-4-hydroxy-2-(hydroxymethyl)-6-[(1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethyl-5-oxaspiro[pentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-piperidin]-18-eneoxy]-5-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol
  • (3b,22a,25R)-Spirosol-5-en-3-yl O-6-deoxy-a-L-mannopyranosyl-(1?2)-O-[6-deoxy-a-L-mannopyranosyl -(1?4)]-b-D-glucopyranoside
  • (3beta,22alpha,25R)-Spirosol-5-en-3-yl O-6-deoxy-alpha-L-mannopyranosyl-(1-->2)-O-[6-deoxy-alpha-L-mannopyranosyl-(1-->4)]-beta-D-glucopyranoside
  • (3ss,22a,25R)-Spirosol-5-en-3-yl O-6-deoxy-a-L-mannopyranosyl-(1?2)-O-[6-deoxy-a-L-mannopyranosyl-(1?4)]-ss-D-glucopyranoside; NSC 407810; Solamargin; a-Solamargine; d-Solanigrine;
  • [(22R,25R)-Spirosola-5-ene-3beta-yl]2-O,4-O-bis(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside
  • b-D-Glucopyranoside, (3b,22a,25R)-spirosol-5-en-3-yl O-6-deoxy-a-L-mannopyranosyl-(1(R)2)-O-[6-deoxy-a-L-mannopyranosyl-(1(R)4)]-
  • beta-D-Glucopyranoside, (3beta,22alpha,25R)-spirosol-5-en-3-yl O-6-deoxy-alpha-L-mannopyranosyl-(1-->2)-O-[6-deoxy-alpha-L-mannopyranosyl-(1-->4)]-
  • rac-(2S,3R,4R,5R,6S)-2-methyl-6-[rac-(2R,3S,4S,5R,6R)-4-hydroxy-2-(hydroxymethyl)-6-[rac-(1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-piperidine]-16-yl]oxy-5-[rac-(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-3-yl]oxy-tetrahydropyran-3,4,5-triol