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Substance Name: Lemmatoxin C
RN: 52230-11-2
InChIKey: QMJCVEOVVBBZDW-XGJOVNJQSA-N

Molecular Formula

  • Unspecified

Molecular Weight

  • 927.1272
 
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Names and Synonyms

  • Lemmatoxin C

Registry Numbers

CAS Registry Number

  • 52230-11-2

System Generated Number

  • 0052230112

Structure Descriptors

InChI

1S/C48H78O17/c1-22-30(51)33(54)36(57)39(60-22)64-38-35(56)32(53)26(21-50)62-41(38)65-37-34(55)31(52)25(20-49)61-40(37)63-29-12-13-45(6)27(44(29,4)5)11-14-47(8)28(45)10-9-23-24-19-43(2,3)15-17-48(24,42(58)59)18-16-46(23,47)7/h9,22,24-41,49-57H,10-21H2,1-8H3,(H,58,59)/t22-,24?,25+,26-,27?,28?,29?,30-,31+,32-,33+,34-,35+,36+,37+,38-,39-,40-,41+,45?,46+,47?,48?/m0/s1

InChIKey

QMJCVEOVVBBZDW-XGJOVNJQSA-N

Smiles

C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2[C@@H]([C@H]([C@@H](O[C@@H]2O[C@@H]3[C@H]([C@@H]([C@H](O[C@H]3OC4CCC5(C(C4(C)C)CCC6(C5CC=C7[C@]6(CCC8(C7CC(CC8)(C)C)C(=O)O)C)C)C)CO)O)O)CO)O)O)O)O)O