(Q105130717)

English

[(3R,4S,5R,6S)-6-[2-[(3R,3aR,5R,7aS)-3a-acetyl-3-hydroxy-7a-methyl-2,3,4,5,6,7-hexahydro-1H-inden-5-yl]propan-2-yloxy]-4,5-diacetyloxyoxan-3-yl] acetate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

chemical compound

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mass

512.26214748 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(3R,4S,5R,6S)-6-[2-[(3R,3aS,5R,7aS)-3a-acetyl-3-hydroxy-7a-methyl-2,3,4,5,6,7-hexahydro-1H-inden-5-yl]propan-2-yloxy]-4,5-diacetyloxyoxan-3-yl] acetate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₆H₄₀O₁₀

0 references

canonical SMILES

O=C(OC1COC(OC(C)(C)C2CCC3(C)CCC(O)C3(C(=O)C)C2)C(OC(=O)C)C1OC(=O)C)C

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isomeric SMILES

CC(=O)O[C@H]1[C@H](OC(C)=O)CO[C@@H](OC(C)(C)[C@@H]2CC[C@@]3(C)CC[C@@H](O)[C@@]3(C(C)=O)C2)[C@@H]1OC(C)=O

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found in taxon

Iphiona scabra

1 reference

stated in

Sesquiterpene xylosides from Iphiona scabra

Identifiers

InChI

InChI=1S/C26H40O10/c1-14(27)26-12-18(8-10-25(26,7)11-9-20(26)31)24(5,6)36-23-22(35-17(4)30)21(34-16(3)29)19(13-32-23)33-15(2)28/h18-23,31H,8-13H2,1-7H3/t18-,19-,20-,21+,22-,23+,25+,26+/m1/s1

0 references

InChIKey

JLHWZNYRZMQCJE-AIUFNOAXSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

JLHWZNYRZMQCJE-AIUFNOAXSA-N

(Q105130717)

[(3R,4S,5R,6S)-6-[2-[(3R,3aR,5R,7aS)-3a-acetyl-3-hydroxy-7a-methyl-2,3,4,5,6,7-hexahydro-1H-inden-5-yl]propan-2-yloxy]-4,5-diacetyloxyoxan-3-yl] acetate

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Identifiers

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