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Substance Name: Fibraurecdyside A
RN: 960506-35-8
InChIKey: MQWJGLSZBHVGLN-VBSSPFTJSA-N

Molecular Formula

  • C34-H56-O12

Molecular Weight

  • 656.8044
 
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Names and Synonyms

Results Name

  • Fibraurecdyside A

Synonym

  • Fibraurecdyside A

Systematic Name

  • Ergost-7-en-6-one, 3-(beta-D-glucopyranosyloxy)-2,14,20,22,25-pentahydroxy-, (2beta,3beta,5beta,22R,24R)-

Registry Numbers

CAS Registry Number

  • 960506-35-8

System Generated Number

  • 0960506358

Structure Descriptors

InChI

1S/C34H56O12/c1-16(30(2,3)42)11-25(38)33(6,43)24-8-10-34(44)18-12-20(36)19-13-22(45-29-28(41)27(40)26(39)23(15-35)46-29)21(37)14-31(19,4)17(18)7-9-32(24,34)5/h12,16-17,19,21-29,35,37-44H,7-11,13-15H2,1-6H3/t16-,17+,19+,21+,22-,23-,24+,25-,26-,27+,28-,29-,31-,32-,33-,34-/m1/s1

InChIKey

MQWJGLSZBHVGLN-VBSSPFTJSA-N

Smiles

C[C@H](C[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C)C(C)(C)O