(Q104986835)

English

beta-D-Glucopyranose, 1-[(1S,4aS,5R,8aS)-5-[(3E)-5-(beta-D-glucopyranosyloxy)-3-methyl-3-penten-1-yl]decahydro-1,4a-dimethyl-6-methylene-1-naphthalenecarboxylate]

group of stereoisomers with the chemical formula C₃₂H₅₂O₁₃

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instance of

group of stereoisomers

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1 reference

644.3407917239999 dalton

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based on heuristic

inferred from InChI

chemical formula

C₃₂H₅₂O₁₃

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canonical SMILES

O=C(OC1OC(CO)C(O)C(O)C1O)C2(C)CCCC3(C)C(C(=C)CCC23)CCC(=CCOC4OC(CO)C(O)C(O)C4O)C

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found in taxon

Rubus foliolatus

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stated in

Labdane-Type Diterpene Glycosides from Fruits of Rubus foliolosus.

Rubus foliosus

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stated in

Labdane-Type Diterpene Glycosides from Fruits of Rubus foliolosus.

Identifiers

InChI

InChI=1S/C32H52O13/c1-16(10-13-42-28-26(39)24(37)22(35)19(14-33)43-28)6-8-18-17(2)7-9-21-31(18,3)11-5-12-32(21,4)30(41)45-29-27(40)25(38)23(36)20(15-34)44-29/h10,18-29,33-40H,2,5-9,11-15H2,1,3-4H3

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InChIKey

DQBCTTXPKJBNHF-UHFFFAOYSA-N

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CAS Registry Number

90851-26-6

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stated in

CAS (formerly Chemical Abstracts Service)

25 January 2022

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

DQBCTTXPKJBNHF-UHFFFAOYSA-N

DSSTox substance ID

DTXSID801099921

1 reference

matched by identifier from

InChIKey

DQBCTTXPKJBNHF-UHFFFAOYSA-N

(Q104986835)

beta-D-Glucopyranose, 1-[(1S,4aS,5R,8aS)-5-[(3E)-5-(beta-D-glucopyranosyloxy)-3-methyl-3-penten-1-yl]decahydro-1,4a-dimethyl-6-methylene-1-naphthalenecarboxylate]

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Identifiers

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