(Q105216329)

English

2,4,6-trihydroxy-5-[(1S)-1-[(4S)-4-hydroxy-6-(2-hydroxypropan-2-yl)-4,8a-dimethyl-octahydronaphthalen-1-yl]-3-methylbutyl]benzene-1,3-dicarbaldehyde

group of stereoisomers with the chemical formula C₂₈H₄₂O₇

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Statements

group of stereoisomers

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chemical compound

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490.293053684 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₂₈H₄₂O₇

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canonical SMILES

O=CC=1C(O)=C(C=O)C(O)=C(C1O)C(CC(C)C)C2CCC(O)(C)C3CC(CCC23C)C(O)(C)C

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isomeric SMILES

CC(C)C[C@H](c1c(O)c(C=O)c(O)c(C=O)c1O)C1CC[C@](C)(O)C2CC(C(C)(C)O)CCC12C

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Identifiers

InChI=1S/C28H42O7/c1-15(2)11-17(22-24(32)18(13-29)23(31)19(14-30)25(22)33)20-8-10-28(6,35)21-12-16(26(3,4)34)7-9-27(20,21)5/h13-17,20-21,31-35H,7-12H2,1-6H3/t16?,17-,20?,21?,27?,28-/m0/s1

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PXQFFMATXFLUPK-HMVMQGJUSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

PXQFFMATXFLUPK-HMVMQGJUSA-N

UniChem compound ID

1 reference

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