(Q105226992)

English

(2R,3R,4S,5S,6R)-2-[(E)-7-hydroxy-3,7-dimethyloct-2-enoxy]-6-[[(2S,3R,4R,5S)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxane-3,4,5-triol

chemical compound

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instance of

type of chemical entity

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subclass of

2-(7-Hydroxy-3,7-dimethyloct-2-enoxy)-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxane-3,4,5-triol

1 reference

based on heuristic

inferred from SMILES

mass

466.241412036 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₁H₃₈O₁₁

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canonical SMILES

OC1COC(OCC2OC(OCC=C(C)CCCC(O)(C)C)C(O)C(O)C2O)C(O)C1O

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isomeric SMILES

C/C(=C\CO[C@@H]1O[C@H](CO[C@@H]2OC[C@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)CCCC(C)(C)O

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found in taxon

Rhodiola crenulata

1 reference

stated in

Bioactive constituents from Chinese natural medicines. XXVIII. Chemical structures of acyclic alcohol glycosides from the roots of Rhodiola crenulata

Rhodiola sachalinensis

2 references

stated in

Bioactive constituents from chinese natural medicines. XXIX. Monoterpene and monoterpene glycosides from the roots of Rhodiola sachalinensis

stated in

Revised absolute stereochemistry of rhodiolosides A-D, rhodiolol A and sachalinol A from Rhodiola rosea

Rhodiola rosea

3 references

stated in

Revised absolute stereochemistry of rhodiolosides A-D, rhodiolol A and sachalinol A from Rhodiola rosea

stated in

Bioactive constituents from chinese natural medicines. XXIX. Monoterpene and monoterpene glycosides from the roots of Rhodiola sachalinensis

stated in

Rhodiolosides A-E, monoterpene glycosides from Rhodiola rosea.

Identifiers

InChI

InChI=1S/C21H38O11/c1-11(5-4-7-21(2,3)28)6-8-29-20-18(27)16(25)15(24)13(32-20)10-31-19-17(26)14(23)12(22)9-30-19/h6,12-20,22-28H,4-5,7-10H2,1-3H3/b11-6+/t12-,13+,14+,15+,16-,17+,18+,19-,20+/m0/s1

0 references

InChIKey

QSGZRCKKGZPIIZ-RPXSYWBFSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

QSGZRCKKGZPIIZ-RPXSYWBFSA-N

(Q105226992)

(2R,3R,4S,5S,6R)-2-[(E)-7-hydroxy-3,7-dimethyloct-2-enoxy]-6-[[(2S,3R,4R,5S)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxane-3,4,5-triol

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Identifiers

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