(Q105033070)

English

(4aS,6aR,6aS,6bR,8aS,9R,10S,12aR,14bS)-9-(hydroxymethyl)-6a,6b,9,12a-tetramethyl-2-methylidene-10-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

chemical compound

In more languages

edit

Statements

instance of

type of chemical entity

0 references

subclass of

9-(hydroxymethyl)-6a,6b,9,12a-tetramethyl-2-methylidene-10-[(3,4,5-trihydroxyoxan-2-yl)oxy]-1,3,4,5,6,7,8,8a,10,11,12,12b,13,14b-tetradecahydropicene-4a-carboxylic acid

1 reference

based on heuristic

inferred from SMILES

mass

588.366218624 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(4aS,6aR,6aS,6bR,8aS,9R,10S,12aR,14bR)-9-(hydroxymethyl)-6a,6b,9,12a-tetramethyl-2-methylidene-10-[(2R,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₄H₅₂O₈

0 references

canonical SMILES

O=C(O)C12CCC(=C)CC2C3=CCC4C5(C)CCC(OC6OCC(O)C(O)C6O)C(C)(CO)C5CCC4(C)C3(C)CC1

0 references

isomeric SMILES

C=C1CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@H]5CC[C@]43C)[C@@H]2C1

0 references

found in taxon

Akebia quinata

1 reference

stated in

30-Noroleanane saponins from callus tissues of Akebia quinata

Identifiers

InChI

InChI=1S/C34H52O8/c1-19-8-13-34(29(39)40)15-14-32(4)20(21(34)16-19)6-7-24-30(2)11-10-25(42-28-27(38)26(37)22(36)17-41-28)31(3,18-35)23(30)9-12-33(24,32)5/h6,21-28,35-38H,1,7-18H2,2-5H3,(H,39,40)/t21-,22-,23-,24+,25-,26-,27+,28-,30-,31-,32+,33+,34-/m0/s1

0 references

InChIKey

HSJBIEXPKJNURK-ZKQIFPOISA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

HSJBIEXPKJNURK-ZKQIFPOISA-N

(Q105033070)

(4aS,6aR,6aS,6bR,8aS,9R,10S,12aR,14bS)-9-(hydroxymethyl)-6a,6b,9,12a-tetramethyl-2-methylidene-10-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

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)