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Substance Name: Alangidiol
RN: 59076-81-2
InChIKey: DNXPKFMWGNHGAW-KVPMBGHQSA-N

Note

  • Isolated from leaves of Sophora gluaca Lesch.

Molecular Formula

  • C30-H52-O2

Molecular Weight

  • 444.7388
 
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Names and Synonyms

Name of Substance

  • Alangidiol

Systematic Name

  • B':A'-Neogammacerane-3,18-diol, (3beta,18alpha)-

Registry Numbers

CAS Registry Number

  • 59076-81-2

System Generated Number

  • 0059076812

Structure Descriptors

InChI

1S/C30H52O2/c1-19(2)20-11-16-30(32)23-10-9-22-26(5)14-13-24(31)25(3,4)21(26)12-15-28(22,7)29(23,8)18-17-27(20,30)6/h19-24,31-32H,9-18H2,1-8H3/t20-,21+,22-,23+,24+,26+,27-,28-,29-,30+/m1/s1

InChIKey

DNXPKFMWGNHGAW-KVPMBGHQSA-N

Smiles

CC(C)[C@H]1CC[C@]2(O)[C@H]3CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@]12C