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Substance Name: Amphidinolide C
RN: 112945-21-8
InChIKey: RNKCEFQNDOJBLW-KNMVVXRTSA-N

Note

  • A potent cytotoxic 25-membered macrolide from marine dinoflagellate Amphidinium sp.

Molecular Formula

  • C41-H62-O10

Molecular Weight

  • 714.931
 
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Names and Synonyms

Results Name

  • Amphidinolide C

Synonym

  • Amphidinolide C

Systematic Name

  • 3,26,27-Trioxatricyclo(21.2.1.16,9)heptacos-13-ene-4,18,21-trione, 10,11,16-trihydroxy-2-((1E,3E,5S)-5-hydroxy-4-methyl-6-methylene-1,3-decadienyl)-7,14,15,19-tetramethyl-12-methylene-, (1R,2R,6S,7R,9R,10R,11R,13E,15R,16S,19S,23R)-

Registry Numbers

CAS Registry Number

  • 112945-21-8

Other Registry Number

  • 111870-67-8

System Generated Number

  • 0112945218

Structure Descriptors

InChI

1S/C41H62O10/c1-9-10-12-23(2)39(46)24(3)13-11-14-34-35-16-15-31(49-35)20-30(42)18-26(5)32(43)21-33(44)29(8)25(4)17-28(7)40(47)41(48)37-19-27(6)36(50-37)22-38(45)51-34/h11,13-14,17,26-27,29,31,33-37,39-41,44,46-48H,2,7,9-10,12,15-16,18-22H2,1,3-6,8H3/b14-11+,24-13+,25-17+/t26-,27+,29+,31+,33-,34+,35+,36-,37+,39-,40+,41-/m0/s1

InChIKey

RNKCEFQNDOJBLW-KNMVVXRTSA-N

Smiles

O[C@H](\C(=C\C=C\[C@H]1OC(C[C@@H]2O[C@H](C[C@H]2C)[C@H](O)[C@H](O)C(C=C([C@H]([C@H](CC([C@@H](C)CC(C[C@H]2CC[C@@H]1O2)=O)=O)O)C)C)=C)=O)C)C(CCCC)=C