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Substance Name: Fuladectin component A4 [INN]
RN: 150702-32-2
UNII: 9BU074500U
InChIKey: XJOFEBZJEMUNMY-QZCZRXKPSA-N

Molecular Formula

  • C42-H59-N-O10-S

Molecular Weight

  • 769.9911
 
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Names and Synonyms

Name of Substance

  • Fuladectin component A4 [INN]

Synonyms

  • 4'-(2-(((2aE,4E,5'S,6S,6'R,7R,8E,11R,13R,15S,17aR,20R,20aR,20bS)-6'-Ethyl-3',4',5',6,6',7,10,11,14,15,17a,20,20a,20b-tetradecahydro-20,20b-dihydroxy-5',6,8,19-tetramethyl-17-oxospiro(11,15-methano-2H,13H,17H-furo(4,3,2-pq)(2,6)benzodioxacyclooctadecin-13,2'-(2H)pyran)-7-yl)oxy)ethyl)-N-methylmethanesulfonanilide
  • Fuladectin component A4
  • UNII-9BU074500U

Registry Numbers

CAS Registry Number

  • 150702-32-2

FDA UNII

  • 9BU074500U

System Generated Number

  • 0150702322

Structure Descriptors

InChI

1S/C42H59NO10S/c1-8-36-26(2)18-20-41(53-36)24-34-23-33(52-41)17-12-28(4)38(49-21-19-30-13-15-32(16-14-30)43(6)54(7,47)48)27(3)10-9-11-31-25-50-39-37(44)29(5)22-35(40(45)51-34)42(31,39)46/h9-16,22,26-27,33-39,44,46H,8,17-21,23-25H2,1-7H3/b10-9+,28-12+,31-11+/t26-,27-,33+,34-,35-,36+,37+,38+,39+,41+,42+/m0/s1

InChIKey

XJOFEBZJEMUNMY-QZCZRXKPSA-N

Smiles

[C@]12([C@H]3[C@@H](C(=C[C@H]1C(=O)O[C@H]1C[C@H](O[C@@]4(CC[C@@H]([C@H](O4)CC)C)C1)CC=C([C@H](OCCc1ccc(cc1)N(C)S(=O)(=O)C)[C@H](C=CC=C2CO3)C)C)C)O)O