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CAS 38-26-6

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Holothurin A

Description:
Holothurin A is a bioactive compound derived from certain species of sea cucumbers, particularly those belonging to the Holothuroidea class. It is classified as a saponin, which is characterized by its surfactant properties and ability to form stable foams in aqueous solutions. Holothurin A exhibits a complex molecular structure, typically featuring a steroid-like backbone with various sugar moieties attached, contributing to its biological activity. This compound is known for its potential pharmacological effects, including anti-inflammatory, antifungal, and cytotoxic properties, making it of interest in medicinal chemistry and pharmacology. Additionally, Holothurin A has been studied for its role in marine ecology, particularly in the context of its interactions with other marine organisms. Its unique properties and biological activities make it a subject of ongoing research, particularly in the fields of natural product chemistry and drug development. However, due to its complex structure, the synthesis and extraction of Holothurin A can be challenging, necessitating advanced techniques in organic chemistry.
Formula:C54H86O27S·Na
InChI:InChI=1S/C54H86O27S.Na/c1-22-39(76-45-38(64)41(33(59)26(20-56)74-45)77-44-37(63)40(70-9)32(58)25(19-55)73-44)35(61)36(62)43(72-22)78-42-34(60)27(81-82(67,68)69)21-71-46(42)75-30-13-15-50(6)24-18-29(57)54-47(65)80-52(8,31-12-14-48(2,3)79-31)53(54,66)17-16-51(54,7)23(24)10-11-28(50)49(30,4)5;/h18,22-23,25-46,55-64,66H,10-17,19-21H2,1-9H3,(H,67,68,69);/t22-,23-,25-,26-,27-,28+,29+,30+,31+,32-,33-,34+,35-,36-,37-,38-,39-,40+,41+,42-,43+,44+,45+,46+,50-,51+,52+,53+,54-;/m1./s1
InChI key:InChIKey=FJCHIEZSNQGYMV-VOFJYVFSSA-N
SMILES:C[C@]12[C@@]3([C@@](O)([C@@](C)(OC3=O)[C@@]4(CCC(C)(C)O4)[H])CC1)[C@@H](O)C=C5[C@]2(CC[C@@]6([C@]5(C)CC[C@H](O[C@H]7[C@H](O[C@H]8[C@H](O)[C@@H](O)[C@H](O[C@H]9[C@H](O)[C@@H](O[C@H]%10[C@H](O)[C@@H](OC)[C@H](O)[C@@H](CO)O%10)[C@H](O)[C@@H](CO)O9)[C@@H](C)O8)[C@@H](O)[C@H](OS(=O)(=O)O)CO7)C6(C)C)[H])[H].[Na]
Synonyms:
  • Holothurin A
  • 1H,3H-Naphth[2′,1′:4,5]indeno[1,7a-c]furan, lanost-9(11)-en-18-oic acid deriv.
  • Lanost-9(11)-en-18-oic acid, 22,25-epoxy-12,17,20-trihydroxy-3-[(O-3-O-methyl-β-D-glucopyranosyl-(1→3)-O-β-D-glucopyranosyl-(1→4)-O-6-deoxy-β-D-glucopyranosyl-(1→2)-4-O-sulfo-β-D-xylopyranosyl)oxy]-, γ-lactone, monosodium salt, (3β,12α,22S)-
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