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Substance Name: Goniodomin A
RN: 112923-40-7
InChIKey: UBLDAHNUOSMNHW-JYRVWZFOSA-N

Note

  • Polyether macrolide; metabolite of Goniodoma pseudogoniaulax.

Classification Code

  • Natural Product

Molecular Formula

  • C43-H60-O12

Molecular Weight

  • 768.935
 
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Names and Synonyms

Name of Substance

  • Goniodomin A

Synonyms

  • BRN 4640743
  • Goniodomin A

Systematic Name

  • 22,33,34,35,36,37-Hexaoxahexacyclo(27.3.1.1(sup 1,5).1(sup 6,10).1(sup 11,14).1(sup 24,28))heptatriaconta-8,19-dien-23-one, 31-methyl-21-(tetrahydro-2-hydroxy-3,4-dimethyl-2H-pyran-2-yl)-2,15,25,30-tetrakis(methylene)-16,17,27-trihydroxy-

Registry Numbers

CAS Registry Number

  • 112923-40-7

System Generated Number

  • 0112923407

Structure Descriptors

InChI

1S/C43H60O12/c1-22-18-19-49-43(48,28(22)7)36-13-8-10-29(44)37(46)27(6)31-16-17-34(50-31)32-11-9-12-33(51-32)35-15-14-25(4)42(54-35)21-24(3)26(5)39(55-42)40-30(45)20-23(2)38(53-40)41(47)52-36/h8-9,11,13,22,24,28-40,44-46,48H,2,4-6,10,12,14-21H2,1,3,7H3/b13-8-

InChIKey

UBLDAHNUOSMNHW-JYRVWZFOSA-N

Smiles

O1[C@@]([C@@H]([C@@H](CC1)C)C)([C@@H]1C=CC[C@@H](O)[C@@H](O)C([C@@H]2O[C@@H](CC2)[C@@H]2O[C@@H](CC=C2)[C@@H]2O[C@@]3(C(CC2)=C)C[C@@H](C([C@@H](O3)[C@@H]2[C@@H](CC([C@@H](C(O1)=O)O2)=C)O)=C)C)=C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 700ug/kg (0.7mg/kg) GASTROINTESTINAL: PERITONITIS

ENDOCRINE: OTHER CHANGES

LIVER: OTHER CHANGES
Toxicon. Vol. 27, Pg. 269, 1989.