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Substance Name: Symphytoxide A
RN: 149475-29-6
InChIKey: RBCDYSPAGZIIFK-XRKXVPSHSA-N

Note

  • Isolated from the roots of Symphytum officinale.

Molecular Formula

  • C47-H76-O18

Molecular Weight

  • 929.0994
 
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Names and Synonyms

Name of Substance

  • Symphytoxide A

Synonym

  • 3-O-(beta-D-Glucopyranosyl-(1-2)-beta-D-glucopyranosyl-(1-4)-alpha-L-arabinopyranosyl)hederagenin

Systematic Name

  • Olean-12-en-28-oic-acid, 3-((O-beta-D-glucopyranosyl-(1-2)-O-beta-D-glucopyranosyl-(1-4)-alpha-L-arabinopyranosyl)oxy)-23-hydroxy-, (3beta,4alpha)-

Registry Numbers

CAS Registry Number

  • 149475-29-6

System Generated Number

  • 0149475296

Structure Descriptors

InChI

1S/C47H76O18/c1-42(2)13-15-47(41(58)59)16-14-45(5)22(23(47)17-42)7-8-28-43(3)11-10-29(44(4,21-50)27(43)9-12-46(28,45)6)63-40-37(65-39-35(57)33(55)31(53)26(19-49)62-39)36(24(51)20-60-40)64-38-34(56)32(54)30(52)25(18-48)61-38/h7,23-40,48-57H,8-21H2,1-6H3,(H,58,59)/t23-,24+,25-,26-,27?,28-,29+,30-,31-,32+,33+,34-,35-,36+,37-,38-,39-,40+,43+,44?,45-,46-,47+/m1/s1

InChIKey

RBCDYSPAGZIIFK-XRKXVPSHSA-N