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Substance Name: Hymenolane
RN: 62121-29-3
InChIKey: XUCKYCQJMPCOTH-TZCKWNCHSA-N

Classification Code

  • Natural Product

Molecular Formula

  • C21-H30-O8

Molecular Weight

  • 410.46
 
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Names and Synonyms

Results Name

  • Hymenolane

Synonyms

  • BRN 1357654
  • Hymenolane

Systematic Name

  • Azuleno(6,5-b)furan-2(3H)-one, decahydro-3,4a,8-trimethyl-5,6,7-tris(acetyloxy)-, (3S-(3-alpha,3a-beta,4a-alpha,5-alpha,6-beta,7-beta,7a-beta,8-beta,9a-beta))-

Registry Numbers

CAS Registry Number

  • 62121-29-3

System Generated Number

  • 0062121293

Structure Descriptors

InChI

1S/C21H30O8/c1-9-7-15-14(10(2)20(25)29-15)8-21(6)16(9)17(26-11(3)22)18(27-12(4)23)19(21)28-13(5)24/h9-10,14-19H,7-8H2,1-6H3/t9-,10+,14-,15-,16-,17-,18-,19+,21+/m1/s1

InChIKey

XUCKYCQJMPCOTH-TZCKWNCHSA-N

Smiles

O1[C@H]2[C@@H]([C@@H](C1=O)C)C[C@@]1([C@H]([C@@H]([C@@H]([C@H]1[C@@H](C2)C)OC(=O)C)OC(=O)C)OC(=O)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 200mg/kg (200mg/kg)   Research Communications in Chemical Pathology and Pharmacology. Vol. 28, Pg. 189, 1980.