(Q105179334)

English

(1R,2R,6S,7S,8R,10S,11S,12R,16S,17R,18R)-6,7-dihydroxy-8-(hydroxymethyl)-4,18-dimethyl-14-(nona-1,3-dien-1-yl)-5-oxo-16-(prop-1-en-2-yl)-9,13,15,19-tetraoxahexacyclo[12.4.1.0¹,¹¹.0²,⁶.0⁸,¹⁰.0¹²,¹⁶]nonadec-3-en-17-yl acetate

group of stereoisomers with the chemical formula C₃₂H₄₂O₁₀

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instance of

group of stereoisomers

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1 reference

586.2777975439999 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

chemical formula

C₃₂H₄₂O₁₀

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canonical SMILES

O=C(OC1C(C)C23OC4(OC(C3C5OC5(CO)C(O)C6(O)C(=O)C(=CC62)C)C1(O4)C(=C)C)C=CC=CCCCCC)C

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isomeric SMILES

C=C(C)[C@@]12OC3(C=CC=CCCCCC)O[C@@H]1[C@@H]1[C@@H]4O[C@]4(CO)[C@@H](O)[C@]4(O)C(=O)C(C)=C[C@H]4[C@@]1(O3)[C@H](C)[C@H]2OC(C)=O

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Identifiers

InChI

InChI=1S/C32H42O10/c1-7-8-9-10-11-12-13-14-29-40-26-22-25-28(16-33,39-25)27(36)30(37)21(15-18(4)23(30)35)32(22,42-29)19(5)24(38-20(6)34)31(26,41-29)17(2)3/h11-15,19,21-22,24-27,33,36-37H,2,7-10,16H2,1,3-6H3/t19-,21-,22+,24-,25+,26-,27-,28+,29?,30-,31+,32+/m1/s1

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InChIKey

NHELFTYSELEEFD-FSMVZZQGSA-N

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PubChem CID

162910022

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

NHELFTYSELEEFD-FSMVZZQGSA-N

(Q105179334)

(1R,2R,6S,7S,8R,10S,11S,12R,16S,17R,18R)-6,7-dihydroxy-8-(hydroxymethyl)-4,18-dimethyl-14-(nona-1,3-dien-1-yl)-5-oxo-16-(prop-1-en-2-yl)-9,13,15,19-tetraoxahexacyclo[12.4.1.0¹,¹¹.0²,⁶.0⁸,¹⁰.0¹²,¹⁶]nonadec-3-en-17-yl acetate

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