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Substance Name: Aleurodiscal
RN: 122535-46-0
InChIKey: PGDQFMJGCJTDBU-XKRAMSRFSA-N

Note

  • Isolated from Aleurodiscus mirabilis.

Classification Code

  • Mutation Data

Molecular Formula

  • C30-H46-O6

Molecular Weight

  • 502.687
 
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Names and Synonyms

Name of Substance

  • Aleurodiscal

Synonym

  • Aleurodiscal

Systematic Name

  • Cyclopenta(4,5)cyclooct(1,2-f)indene-6-carboxaldehyde, 1,2,3,3a,4,6a,7,7a,8,9,10,10a,11,11a-tetradecahydro-10-(1-methylethyl)-3,7a,12-trimethyl-2-(beta-D-xylopyranosyloxy)-, (2S-(2-alpha,3-beta,3a-beta,6a-alpha,7a-alpha,10-beta,10a-beta,11a-beta))-

Registry Numbers

CAS Registry Number

  • 122535-46-0

System Generated Number

  • 0122535460

Structure Descriptors

InChI

1S/C30H46O6/c1-15(2)19-8-9-30(5)12-23-18(13-31)6-7-20-17(4)26(11-22(20)16(3)21(23)10-24(19)30)36-29-28(34)27(33)25(32)14-35-29/h6,13,15,17,19-21,23-29,32-34H,7-12,14H2,1-5H3/b18-6-,22-16-/t17-,19-,20-,21+,23+,24-,25+,26-,27-,28+,29-,30+/m0/s1

InChIKey

PGDQFMJGCJTDBU-XKRAMSRFSA-N

Smiles

C1[C@H]([C@@H]2C[C@H]3[C@H](C[C@@]2(C1)C)C(=CC[C@@H]1C(=C3C)C[C@@H]([C@H]1C)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)CO1)C=O)C(C)C