(Q105280634)

English

(2R,17R,19S)-12-hydroxy-19-[(2E)-4-hydroxy-3-methylbut-2-en-1-yl]-8,8,21,21-tetramethyl-5-(3-methylbut-2-en-1-yl)-3,7,20-trioxahexacyclo[15.4.1.0²,¹⁵.0²,¹⁹.0⁴,¹³.0⁶,¹¹]docosa-4(13),5,9,11,15-pentaene-14,18-dione

group of stereoisomers with the chemical formula C₃₃H₃₈O₇

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

546.2617535559999 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

chemical formula

C₃₃H₃₈O₇

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canonical SMILES

O=C1C2=C(O)C=3C=CC(OC3C(=C2OC45C1=CC6C(=O)C5(OC(C)(C)C4C6)CC=C(C)CO)CC=C(C)C)(C)C

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isomeric SMILES

CC(C)=CCc1c2c(c(O)c3c1O[C@@]14C(=C[C@H]5CC1C(C)(C)O[C@]4(C/C=C(\C)CO)C5=O)C3=O)C=CC(C)(C)O2

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Identifiers

InChI

InChI=1S/C33H38O7/c1-17(2)8-9-21-27-20(11-12-30(4,5)38-27)25(35)24-26(36)22-14-19-15-23-31(6,7)40-32(29(19)37,13-10-18(3)16-34)33(22,23)39-28(21)24/h8,10-12,14,19,23,34-35H,9,13,15-16H2,1-7H3/b18-10+/t19-,23?,32+,33-/m0/s1

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InChIKey

UWZMGTSPGQXAAP-VHRVKJKHSA-N

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PubChem CID

16078250

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based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

UWZMGTSPGQXAAP-VHRVKJKHSA-N

1 reference

(Q105280634)

(2R,17R,19S)-12-hydroxy-19-[(2E)-4-hydroxy-3-methylbut-2-en-1-yl]-8,8,21,21-tetramethyl-5-(3-methylbut-2-en-1-yl)-3,7,20-trioxahexacyclo[15.4.1.0²,¹⁵.0²,¹⁹.0⁴,¹³.0⁶,¹¹]docosa-4(13),5,9,11,15-pentaene-14,18-dione

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