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Substance Name: Crystallopicrin
RN: 139039-72-8
InChIKey: SNAMORDNHYXHMD-DROBAZEWSA-N

Note

  • From viscid cap of Cortinarius crystallinus and other fungi.

Molecular Formula

  • C30-H54-O6

Molecular Weight

  • 510.751
 
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Names and Synonyms

Name of Substance

  • Crystallopicrin

Synonym

  • Crystallopicrin 1

Systematic Name

  • 1,5,6-Heptanetriol, 2-(7-(3-(2-hydroxy-1-(hydroxymethyl)ethylidene)-2-(3-hydroxypropyl)-1,6-dimethylcyclohexyl)-4-methyl-4-heptenylidene)-6-methyl-

Registry Numbers

CAS Registry Number

  • 139039-72-8

System Generated Number

  • 0139039728

Structure Descriptors

InChI

1S/C30H54O6/c1-22(9-6-11-24(19-32)14-16-28(35)29(3,4)36)10-7-17-30(5)23(2)13-15-26(25(20-33)21-34)27(30)12-8-18-31/h10-11,23,27-28,31-36H,6-9,12-21H2,1-5H3/b22-10+,24-11+

InChIKey

SNAMORDNHYXHMD-DROBAZEWSA-N

Smiles

C(\C(CC[C@@H](C(C)(O)C)O)=C\CC\C(=C\CC[C@@]1([C@@H](\C(CC[C@@H]1C)=C(\CO)CO)CCCO)C)C)O