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Substance Name: Ajugamarin B 1
RN: 121521-88-8
InChIKey: BRIXIZXUQQCUIP-OFLICERBSA-N

Molecular Formula

  • C29-H42-O10

Molecular Weight

  • 550.641
 
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Names and Synonyms

  • Ajugamarin B 1

Registry Numbers

CAS Registry Number

  • 121521-88-8

System Generated Number

  • 0121521888

Structure Descriptors

InChI

1S/C29H42O10/c1-7-16(2)26(34)39-22-8-9-28(14-37-28)29(15-36-18(4)30)23(38-19(5)31)10-17(3)27(6,25(22)29)12-21(32)20-11-24(33)35-13-20/h11,16-17,21-23,25,32H,7-10,12-15H2,1-6H3/t16-,17+,21-,22+,23-,25+,27-,28?,29+/m0/s1

InChIKey

BRIXIZXUQQCUIP-OFLICERBSA-N

Smiles

C([C@H](CC)C)(=O)O[C@@H]1CC[C@@]2([C@@]3([C@H](C[C@H]([C@@]([C@@H]13)(C)C[C@H](O)C=1COC(C1)=O)C)OC(=O)C)COC(=O)C)OC2