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Substance Name: Bullatacin
RN: 123123-32-0
InChIKey: MBABCNBNDNGODA-DACSEHCNSA-N

Molecular Formula

  • C37-H66-O7

Molecular Weight

  • 622.921
 
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Names and Synonyms

Results Name

  • Bullatacin

Synonyms

  • ( )-Bullatacin
  • Annonareticin
  • Bullatacin
  • LI 12105
  • Rolliniastatin 2
  • Squamocin G

Systematic Name

  • 2(5H)-Furanone, 3-(2,13-dihydroxy-13-(octahydro-5'-(1-hydroxyundecyl)(2,2'-bifuran)-5-yl)tridecyl)-5-methyl-, (2R-(2alpha(2'R*,5'R*(S*)),5beta(1(S*),2R*,13R*)))-

Registry Numbers

CAS Registry Number

  • 123123-32-0

Other Registry Numbers

  • 121917-13-3
  • 160023-28-9

System Generated Number

  • 0123123320

Structure Descriptors

InChI

1S/C37H66O7/c1-3-4-5-6-7-11-14-17-20-31(39)33-22-24-35(43-33)36-25-23-34(44-36)32(40)21-18-15-12-9-8-10-13-16-19-30(38)27-29-26-28(2)42-37(29)41/h26,28,30-36,38-40H,3-25,27H2,1-2H3/t28-,30+,31-,32+,33+,34?,35+,36+/m0/s1

InChIKey

MBABCNBNDNGODA-DACSEHCNSA-N

Smiles

O1[C@H](C=C(C[C@@H](CCCCCCCCCC[C@H]([C@@H]2CC[C@@H](O2)[C@@H]2O[C@H](CC2)[C@H](CCCCCCCCCC)O)O)O)C1=O)C