(Q105283122)

English

[(1S,4R,5R,6R,8R,10S,12S,13S,15S,16R,18S,21R)-8-hydroxy-4,6,12,17,17-pentamethyl-18-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-15-yl] acetate

chemical compound

In more languages

edit

Statements

instance of

type of chemical entity

0 references

subclass of

[8-Hydroxy-4,6,12,17,17-pentamethyl-18-(3,4,5-trihydroxyoxan-2-yl)oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-15-yl] acetate

1 reference

based on heuristic

inferred from SMILES

mass

592.361133244 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₃H₅₂O₉

0 references

canonical SMILES

O=C(OC1CC2C3(C)CC4OC(O)CC(C)C4C3(C)CCC52CC65CCC(OC7OCC(O)C(O)C7O)C(C)(C)C16)C

0 references

isomeric SMILES

CC(=O)O[C@H]1C[C@H]2[C@]3(C)C[C@@H]4O[C@@H](O)C[C@@H](C)[C@@H]4[C@@]3(C)CC[C@]23C[C@@]32CC[C@H](O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)C(C)(C)[C@H]12

0 references

found in taxon

Astragalus tomentosus

1 reference

stated in

Antimicrobial isoflavans from Astragalus species

Astragalus fruticosus

1 reference

stated in

Antimicrobial isoflavans from Astragalus species

Astragalus syriacus

1 reference

stated in

Antimicrobial isoflavans from Astragalus species

Identifiers

InChI

InChI=1S/C33H52O9/c1-16-11-23(36)41-20-13-31(6)21-12-19(40-17(2)34)27-29(3,4)22(42-28-26(38)25(37)18(35)14-39-28)7-8-33(27)15-32(21,33)10-9-30(31,5)24(16)20/h16,18-28,35-38H,7-15H2,1-6H3/t16-,18-,19+,20+,21+,22+,23-,24+,25+,26-,27+,28+,30-,31+,32+,33-/m1/s1

0 references

InChIKey

VBAWUAZSNLINMS-HTJXPMPVSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

1 reference

(Q105283122)

[(1S,4R,5R,6R,8R,10S,12S,13S,15S,16R,18S,21R)-8-hydroxy-4,6,12,17,17-pentamethyl-18-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-15-yl] acetate

Statements

Identifiers

Sitelinks

Wikipedia(0 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)