(Q105352163)

English

2-{[1,4a-dimethyl-5-(3-methyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}pent-3-en-1-yl)-6-methylidene-hexahydro-2H-naphthalen-1-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triol

group of stereoisomers with the chemical formula C₃₂H₅₄O₁₂

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instance of

group of stereoisomers

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1 reference

630.361527168 dalton

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based on heuristic

inferred from InChI

chemical formula

C₃₂H₅₄O₁₂

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canonical SMILES

OCC1OC(OCC=C(C)CCC2C(=C)CCC3C(C)(COC4OC(CO)C(O)C(O)C4O)CCCC23C)C(O)C(O)C1O

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Identifiers

InChI

InChI=1S/C32H54O12/c1-17(10-13-41-29-27(39)25(37)23(35)20(14-33)43-29)6-8-19-18(2)7-9-22-31(3,11-5-12-32(19,22)4)16-42-30-28(40)26(38)24(36)21(15-34)44-30/h10,19-30,33-40H,2,5-9,11-16H2,1,3-4H3

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InChIKey

YQDMUEBOTCUADA-UHFFFAOYSA-N

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CAS Registry Number

90851-27-7

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stated in

CAS (formerly Chemical Abstracts Service)

retrieved

25 January 2022

DSSTox substance ID

DTXSID801100231

1 reference

matched by identifier from

InChIKey

YQDMUEBOTCUADA-UHFFFAOYSA-N

(Q105352163)

2-{[1,4a-dimethyl-5-(3-methyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}pent-3-en-1-yl)-6-methylidene-hexahydro-2H-naphthalen-1-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triol

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