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(Q27215487)
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English
2-[4-(1,4-Dihydroxy-2,2,6-trimethylcyclohexyl)but-3-en-2-yloxy]-6-(hydroxymethyl)oxane-3,4,5-triol
chemical compound
In more languages
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Statements
instance of
type of chemical entity
0 references
subclass of
megastigmane
0 references
mass
390.225368048
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₃₄O₈
0 references
canonical SMILES
CC1CC(CC(C)(C)C1(C=CC(C)OC2C(C(C(C(CO)O2)O)O)O)O)O
1 reference
stated in
ChEBI
ChEBI ID
125143
language of work or name
English
title
2-[4-(1,4-dihydroxy-2,2,6-trimethylcyclohexyl)but-3-en-2-yloxy]-6-(hydroxymethyl)oxane-3,4,5-triol
(English)
retrieved
11 October 2016
found in taxon
Sedum
2 references
stated in
Megastigmanes and their glucosides from the whole plant of Sedum sarmentosum
stated in
Bioactive constituents from Chinese natural medicines. XXIII. Absolute structures of new megastigmane glycosides, sedumosides A(4), A(5), A(6), H, and I, and hepatoprotective megastigmanes from Sedum sarmentosum.
Identifiers
InChI
InChI=1S/C19H34O8/c1-10-7-12(21)8-18(3,4)19(10,25)6-5-11(2)26-17-16(24)15(23)14(22)13(9-20)27-17/h5-6,10-17,20-25H,7-9H2,1-4H3
1 reference
stated in
ChEBI
ChEBI ID
125143
language of work or name
English
title
2-[4-(1,4-dihydroxy-2,2,6-trimethylcyclohexyl)but-3-en-2-yloxy]-6-(hydroxymethyl)oxane-3,4,5-triol
(English)
retrieved
11 October 2016
InChIKey
MRPDHXXPDCVBPQ-UHFFFAOYSA-N
2 references
stated in
ChEBI
ChEBI ID
125143
language of work or name
English
title
2-[4-(1,4-dihydroxy-2,2,6-trimethylcyclohexyl)but-3-en-2-yloxy]-6-(hydroxymethyl)oxane-3,4,5-triol
(English)
retrieved
11 October 2016
stated in
ChEBI release 2020-09-01
PubChem CID
73319510
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
MRPDHXXPDCVBPQ-UHFFFAOYSA-N
ChEBI ID
125143
mapping relation type
exact match
2 references
stated in
ChEBI
ChEBI ID
125143
language of work or name
English
title
2-[4-(1,4-dihydroxy-2,2,6-trimethylcyclohexyl)but-3-en-2-yloxy]-6-(hydroxymethyl)oxane-3,4,5-triol
(English)
retrieved
11 October 2016
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C19H34O8/c1-10-7-12(21)8-18(3,4)19(10,25)6-5-11(2)26-17-16(24)15(23)14(22)13(9-20)27-17/h5-6,10-17,20-25H,7-9H2,1-4H3
UniChem compound ID
70473515
1 reference
stated in
UniChem
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