(Q105210598)

English

[4,5-dihydroxy-6-(hydroxymethyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl] 5-[2-(furan-3-yl)-2-oxoethyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate

group of stereoisomers with the chemical formula C₃₂H₄₆O₁₄

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Statements

instance of

group of stereoisomers

0 references

1 reference

654.288756152 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₂H₄₆O₁₄

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canonical SMILES

O=C(OC1OC(CO)C(O)C(O)C1OC2OC(CO)C(O)C(O)C2O)C3(C)CCCC4(C)C(C(=C)CCC34)CC(=O)C5=COC=C5

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found in taxon

Stuckenia pectinata

1 reference

stated in

ent-Labdane diterpenes from the aquatic plant Potamogeton pectinatus

Identifiers

InChI

InChI=1S/C32H46O14/c1-15-5-6-21-31(2,17(15)11-18(35)16-7-10-42-14-16)8-4-9-32(21,3)30(41)46-29-27(25(39)23(37)20(13-34)44-29)45-28-26(40)24(38)22(36)19(12-33)43-28/h7,10,14,17,19-29,33-34,36-40H,1,4-6,8-9,11-13H2,2-3H3

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InChIKey

PKSIMYZPVVVCPE-UHFFFAOYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

PKSIMYZPVVVCPE-UHFFFAOYSA-N

(Q105210598)

[4,5-dihydroxy-6-(hydroxymethyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl] 5-[2-(furan-3-yl)-2-oxoethyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate

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Identifiers

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