(Q105352811)

English

(10'E)-12',14',15',16'-tetrakis(acetyloxy)-3'-hydroxy-9'-(hydroxymethyl)-4',13'-dimethyl-5'-oxo-6'-oxaspiro[oxirane-2,17'-tricyclo[11.4.0.0³,⁷]heptadecane]-8',10'-dien-2'-yl acetate

group of stereoisomers with the chemical formula C₃₀H₃₈O₁₅

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instance of

group of stereoisomers

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638.221070516 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₀H₃₈O₁₅

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canonical SMILES

O=C(OC1C=CC(=CC2OC(=O)C(C)C2(O)C(OC(=O)C)C3C4(OC4)C(OC(=O)C)C(OC(=O)C)C(OC(=O)C)C13C)CO)C

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isomeric SMILES

CC(=O)OC1C(OC(C)=O)C2(CO2)C2C(OC(C)=O)C3(O)C(C=C(CO)/C=C/C(OC(C)=O)C2(C)C1OC(C)=O)OC(=O)C3C

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based on heuristic

inferred from InChI

Identifiers

InChI

InChI=1S/C30H38O15/c1-13-27(37)45-21-10-19(11-31)8-9-20(40-14(2)32)28(7)23(26(30(13,21)38)44-18(6)36)29(12-39-29)25(43-17(5)35)22(41-15(3)33)24(28)42-16(4)34/h8-10,13,20-26,31,38H,11-12H2,1-7H3/b9-8+,19-10?

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InChIKey

YRIFCYVSONYKSX-NLINLPGZSA-N

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(Q105352811)

(10'E)-12',14',15',16'-tetrakis(acetyloxy)-3'-hydroxy-9'-(hydroxymethyl)-4',13'-dimethyl-5'-oxo-6'-oxaspiro[oxirane-2,17'-tricyclo[11.4.0.0³,⁷]heptadecane]-8',10'-dien-2'-yl acetate

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