(Q105224686)

English

[(2S,3R,4S,5R)-2-[2-[(2R,4aR)-4a,8-dimethyl-2,3,4,5,6,7-hexahydro-1H-naphthalen-2-yl]propan-2-yloxy]-4,5-dihydroxyoxan-3-yl] acetate

chemical compound

In more languages

Statements

type of chemical entity

0 references

2-{[2-(4a,8-dimethyl-2,3,4,5,6,7-hexahydro-1H-naphthalen-2-yl)propan-2-yl]oxy}-4,5-dihydroxyoxan-3-yl acetate

1 reference

based on heuristic

inferred from SMILES

396.251188872 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₃₆O₆

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canonical SMILES

O=C(OC1C(OCC(O)C1O)OC(C)(C)C2CC3=C(C)CCCC3(C)CC2)C

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isomeric SMILES

CC(=O)O[C@H]1[C@H](OC(C)(C)[C@@H]2CC[C@@]3(C)CCCC(C)=C3C2)OC[C@@H](O)[C@@H]1O

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Iphiona mucronata

1 reference

Sesquiterpene Xylosides from Iphiona mucronata

1 reference

Sesquiterpene xylosides from Iphiona scabra

Identifiers

InChI=1S/C22H36O6/c1-13-7-6-9-22(5)10-8-15(11-16(13)22)21(3,4)28-20-19(27-14(2)23)18(25)17(24)12-26-20/h15,17-20,24-25H,6-12H2,1-5H3/t15-,17-,18+,19-,20+,22-/m1/s1

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QNWIDTXODBSVCO-RAYWZDFNSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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