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Substance Name: Cannogenol-3-O-beta-D-allomethyloside
RN: 75828-85-2
InChIKey: WPVGSIBYLZQSIK-PWSVBBPESA-N

Molecular Weight

  • 536.658
 
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Names and Synonyms

Results Name

  • Cannogenol-3-O-beta-D-allomethyloside

Synonym

  • cannogenol 3-O-beta-D-allomethyloside

Systematic Name

  • Card-20(22)-enolide, 3-((6-deoxy-beta-D-allopyranosyl)oxy)-14,19-dihydroxy-, (3beta,5beta)-

Registry Numbers

CAS Registry Number

  • 75828-85-2

System Generated Number

  • 0075828852

Structure Descriptors

InChI

1S/C29H44O9/c1-15-23(32)24(33)25(34)26(37-15)38-18-5-9-28(14-30)17(12-18)3-4-21-20(28)6-8-27(2)19(7-10-29(21,27)35)16-11-22(31)36-13-16/h11,15,17-21,23-26,30,32-35H,3-10,12-14H2,1-2H3/t15-,17-,18+,19-,20+,21-,23-,24-,25-,26+,27-,28-,29+/m1/s1

InChIKey

WPVGSIBYLZQSIK-PWSVBBPESA-N

Smiles

C1(C=C([C@H]2CC[C@@]3([C@@]2(CC[C@@H]2[C@@]4([C@@H](C[C@@H](O[C@H]5[C@H](O)[C@H](O)[C@H](O)[C@H](C)O5)CC4)CC[C@@H]32)CO)C)O)CO1)=O