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Substance Name: Milliamine H
RN: 91197-53-4
InChIKey: HRUJEWFJYODYPE-YAJLYFIVSA-N

Note

  • Isolated from Euphorbia milii.

Molecular Formula

  • C37-H42-N2-O9

Molecular Weight

  • 658.744
 
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Names and Synonyms

Name of Substance

  • Milliamine H

Synonym

  • 9a-(Acetyloxy)-1a,1b,4,4a,5,7a,7b,8,9,9a-decahydro-4,4a,7b-trihydroxy-1,1,3,6,8-pentamethyl-5-oxo-1H-cyclopropa(3,4)benz(1,2-e)azulen-9-yl 2-((2-(methylamino)benzoyl)amino)benzoate (1aR-(1aalpha,1bbeta,4beta,4abeta,7aalpha,7balpha,8alpha,9beta,9aalpha))-

Systematic Name

  • Benzoic acid, 2-((2-(methylamino)benzoyl)amino)-, 9a-(acetyloxy)-1a,1b,4,4a,5,7a,7b,8,9,9a-decahydro-4,4a,7b-trihydroxy-1,1,3,6,8-pentamethyl-5-oxo-1H-cyclopropa(3,4)benz(1,2-e)azulen-9-yl ester, (1aR-(1aalpha,1bbeta,4beta,4abeta,7aalpha,7balpha,8alpha,9beta,9aalpha))-

Registry Numbers

CAS Registry Number

  • 91197-53-4

System Generated Number

  • 0091197534

Structure Descriptors

InChI

1S/C37H42N2O9/c1-18-16-24-28-34(5,6)37(28,48-21(4)40)31(20(3)35(24,45)27-17-19(2)30(42)36(27,46)29(18)41)47-33(44)23-13-9-11-15-26(23)39-32(43)22-12-8-10-14-25(22)38-7/h8-17,20,24,27-29,31,38,41,45-46H,1-7H3,(H,39,43)/t20-,24+,27+,28-,29-,31-,35-,36+,37-/m1/s1

InChIKey

HRUJEWFJYODYPE-YAJLYFIVSA-N

Smiles

C(c1c(cccc1)NC(c1c(cccc1)NC)=O)(=O)O[C@H]1[C@@]2([C@@H](C2(C)C)[C@H]2[C@@]([C@@H]3C=C(C([C@@]3([C@@H](C(=C2)C)O)O)=O)C)([C@@H]1C)O)OC(=O)C