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Substance Name: Bivittoside B
RN: 77394-04-8
InChIKey: OWKJBTKHYSAGRF-UHFFFAOYSA-N

Molecular Weight

  • 1089.27
 
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Names and Synonyms

Results Name

  • Bivittoside B

Synonym

  • Bivittoside B

Systematic Name

  • Lanost-9(11)-en-18-oic acid, 3-((O-6-deoxy-beta-D-glucopyranosyl-(1-2)-O-(O-3-O-methyl-beta-D-glucopyranosyl-(1-3)-beta-D-glucopyranosyl-(1-4))-beta-D-xylopyranosyl)oxy)-12,20-dihydroxy-, gamma-lactone, (3beta,12alpha)-

Registry Numbers

CAS Registry Number

  • 77394-04-8

System Generated Number

  • 0077394048

Structure Descriptors

InChI

1S/C54H88O22/c1-23(2)11-10-16-53(8)31-14-18-52(7)25-12-13-30-50(4,5)33(15-17-51(30,6)26(25)19-32(57)54(31,52)49(66)76-53)73-48-44(75-45-39(63)38(62)34(58)24(3)69-45)37(61)29(22-68-48)72-46-41(65)43(36(60)28(21-56)70-46)74-47-40(64)42(67-9)35(59)27(20-55)71-47/h19,23-25,27-48,55-65H,10-18,20-22H2,1-9H3

InChIKey

OWKJBTKHYSAGRF-UHFFFAOYSA-N

Smiles

O1[C@@H]([C@@H]([C@@H]([C@@H]([C@@H]1O[C@@H]1[C@@H](O)[C@@H](O[C@@H]2CO[C@@H]([C@@H](O[C@@H]3[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O3)C)[C@@H]2O)O[C@@H]2C(C)(C)[C@@H]3[C@@](CC2)(C=2[C@@H](CC3)[C@@]3([C@@]4(C(O[C@@]([C@@H]4CC3)(C)CCCC(C)C)=O)[C@@H](C2)O)C)C)O[C@@H](CO)[C@@H]1O)O)OC)O)CO