Chem
J-GLOBAL ID：200907083621334517   Nikkaji number：J862.320A

SR-90107

SR-90107
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C31H53N3O49S8
Molecular formula furigana： C31-H53-N3-O49-S8
Molecular weight： 1508.220
InChI： InChI=1S/C31H53N3O49S8/c1-69-27-9(33-85(48,49)50)13(37)17(6(74-27)3-71-88(57,58)59)76-31-22(83-91(66,67)68)16(40)21(24(81-31)26(43)44)79-29-10(34-86(51,52)53)19(82-90(63,64)65)18(7(75-29)4-72-89(60,61)62)77-30-15(39)14(38)20(23(80-30)25(41)42)78-28-8(32-84(45,46)47)12(36)11(35)5(73-28)2-70-87(54,55)56/h5-24,27-40H,2-4H2,1H3,(H,41,42)(H,43,44)(H,45,46,47)(H,48,49,50)(H,51,52,53)(H,54,55,56)(H,57,58,59)(H,60,61,62)(H,63,64,65)(H,66,67,68)/t5-,6-,7-,8-,9-,10-,11-,12-,13-,14-,15-,16+,17-,18-,19-,20+,21+,22-,23+,24-,27+,28-,29-,30-,31-/m1/s1
InChI key： KANJSNBRCNMZMV-ABRZTLGGSA-N
SMILES： CO[C@H]1O[C@H](COS(=O)(=O)O)[C@@H](O[C@@H]2O[C@H]([C@@H](O[C@H]3O[C@H](COS(=O)(=O)O)[C@@H](O[C@@H]4O[C@@H]([C@@H](O[C@H]5O[C@H](COS(=O)(=O)O)[C@@H](O)[C@H](O)[C@H]5NS(=O)(=O)O)[C@H](O)[C@H]4O)C(=O)O)[C@H](OS(=O)(=O)O)[C@H]3NS(=O)(=O)O)[C@H](O)[C@H]2OS(=O)(=O)O)C(=O)O)[C@H](O)[C@H]1NS(=O)(=O)O
Systematic name  (5)：
  • メチル4-O-[4-O-[4-O-[4-O-[6-O-スルホ-2-(スルホアミノ)-2-デオキシ-α-D-グルコピラノシル]-β-D-グルコピラヌロノシル]-3-O,6-O-ジスルホ-2-(スルホアミノ)-2-デオキシ-α-D-グルコピラノシル]-2-O-スルホ-α-L-イドピラヌロノシル]-6-O-スルホ-2-(スルホアミノ)-2-デオキシ-α-D-グルコピラノシド
  • メチル4-O-[4-O-[4-O-[4-O-[2-デオキシ-6-O-スルホ-2-(スルホアミノ)-α-D-グルコピラノシル]-β-D-グルコピラヌロノシル]-2-デオキシ-3-O,6-O-ビス(スルホ)-2-(スルホアミノ)-α-D-グルコピラノシル]-2-O-スルホ-α-L-イドピラヌロノシル]-2-デオキシ-6-O-スルホ-2-(スルホアミノ)-α-D-グルコピラノシド
  • メチル2-(スルホアミノ)-2-デオキシ-4-O-[2-O-スルホ-4-O-[2-(スルホアミノ)-2-デオキシ-3-O-スルホ-4-O-[4-O-[2-(スルホアミノ)-2-デオキシ-6-O-スルホ-α-D-グルコピラノシル]-β-D-グルコピラヌロノシル]-6-O-スルホ-α-D-グルコピラノシル]-α-L-イドピラヌロノシル]-6-O-スルホ-α-D-グルコピラノシド
  • (2R,3S,4S,5R,6R)-3-{[(2R,3R,4R,5R,6R)-5-{[(2R,3R,4R,5S,6S)-6-カルボキシ-5-{[(2R,3R,4R,5S,6R)-4,5-ジヒドロキシ-3-(スルホアミノ)-6-[(スルホオキシ)メチル]オキサン-2-イル]オキシ}-3,4-ジヒドロキシオキサン-2-イル]オキシ}-3-(スルホアミノ)-4-(スルホオキシ)-6-[(スルホオキシ)メチル]オキサン-2-イル]オキシ}-4-ヒドロキシ-6-{[(2R,3S,4R,5R,6S)-4-ヒドロキシ-6-メトキシ-5-(スルホアミノ)-2-[(スルホオキシ)メチル]オキサン-3-イル]オキシ}-5-(スルホオキシ)オキサン-2-カルボン酸
  • (2R,3S,4S,5R,6R)-3-{[(2R,3R,4R,5R,6R)-5-{[(2R,3R,4R,5S,6S)-6-carboxy-5-{[(2R,3R,4R,5S,6R)-4,5-dihydroxy-3-(sulfoamino)-6-[(sulfooxy)methyl]oxan-2-yl]oxy}-3,4-dihydroxyoxan-2-yl]oxy}-3-(sulfoamino)-4-(sulfooxy)-6-[(sulfooxy)methyl]oxan-2-yl]oxy}-4-hydroxy-6-{[(2R,3S,4R,5R,6S)-4-hydroxy-6-methoxy-5-(sulfoamino)-2-[(sulfooxy)methyl]oxan-3-yl]oxy}-5-(sulfooxy)oxane-2-carboxylic acid
Other name (9)：
  • SR-90107
  • Methyl 4-O-[4-O-[4-O-[4-O-[6-O-sulfo-2-(sulfoamino)-2-deoxy-α-D-glucopyranosyl]-β-D-glucopyranuronosyl]-3-O,6-O-disulfo-2-(sulfoamino)-2-deoxy-α-D-glucopyranosyl]-2-O-sulfo-α-L-idopyranuronosyl]-6-O-sulfo-2-(sulfoamino)-2-deoxy-α-D-glucopyranoside
  • Methyl 2-(sulfoamino)-2-deoxy-4-O-[2-O-sulfo-4-O-[2-(sulfoamino)-2-deoxy-3-O-sulfo-4-O-[4-O-[2-(sulfoamino)-2-deoxy-6-O-sulfo-α-D-glucopyranosyl]-β-D-glucopyranuronosyl]-6-O-sulfo-α-D-glucopyranosyl]-α-L-idopyranuronosyl]-6-O-sulfo-α-D-glucopyranoside
  • GlcNS6S-GlcA-GlcNS6S3S-IdoA2S-GlcNS6SOMe
  • Methyl 4-O-[4-O-[4-O-[4-O-[2-deoxy-6-O-sulfo-2-(sulfoamino)-α-D-glucopyranosyl]-β-D-glucopyranuronosyl]-2-deoxy-3-O,6-O-bis(sulfo)-2-(sulfoamino)-α-D-glucopyranosyl]-2-O-sulfo-α-L-idopyranuronosyl]-2-deoxy-6-O-sulfo-2-(sulfoamino)-α-D-glucopyranoside
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CAS registry number： 104993-28-4
Application (1)：
anticoagulant
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