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Substance Name: L-threo-alpha-D-galacto-Octopyranoside, methyl 7-chloro-6,7,8-trideoxy-6-(((1-methyl-4-propyl-2-pyrrolidinyl)carbonyl)amino)-1-thio-, 2-(phenylmethyl hydrogen phosphate), (2S-trans)-
RN: 124600-31-3
InChIKey: YICKZSJGHDBTKH-FWNHFGBGSA-N

Molecular Formula

  • C25-H40-C-I-N2-O8-P-S

Molecular Weight

  • 595.09
 
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Names and Synonyms

  • L-threo-alpha-D-galacto-Octopyranoside, methyl 7-chloro-6,7,8-trideoxy-6-(((1-methyl-4-propyl-2-pyrrolidinyl)carbonyl)amino)-1-thio-, 2-(phenylmethyl hydrogen phosphate), (2S-trans)-

Registry Numbers

CAS Registry Number

  • 124600-31-3

System Generated Number

  • 0124600313

Structure Descriptors

InChI

1S/C25H40ClN2O8PS/c1-5-9-17-12-18(28(3)13-17)24(31)27-19(15(2)26)22-20(29)21(30)23(25(35-22)38-4)36-37(32,33)34-14-16-10-7-6-8-11-16/h6-8,10-11,15,17-23,25,29-30H,5,9,12-14H2,1-4H3,(H,27,31)(H,32,33)/t15-,17+,18-,19+,20+,21-,22+,23+,25+/m0/s1

InChIKey

YICKZSJGHDBTKH-FWNHFGBGSA-N

Smiles

CCC[C@@H]1C[C@H](N(C)C1)C(=O)N[C@H]([C@H](C)Cl)[C@H]2O[C@H](SC)[C@H](OP(=O)(O)OCc3ccccc3)[C@@H](O)[C@H]2O