(Q110202180)

English

(3-Acetyloxy-6',7',13,14-tetrahydroxy-9',9',16,16-tetramethyl-7-oxospiro[10,12-dioxahexacyclo[9.8.0.01,15.02,8.05,9.08,13]nonadecane-6,21'-3,5,22-trioxaheptacyclo[12.9.0.01,6.02,17.04,13.08,13.018,23]tricos-18(23)-ene]-15'-yl) acetate

group of stereoisomers with the chemical formula C₄₄H₅₆O₁₄

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

808.3670064720004 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₄₄H₅₆O₁₄

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canonical SMILES

O=C(OC1CC2C3=C(OC4(C(=O)C56C7OC8OC6(O)C(O)C9C(C)(C)CCCC89C5C(OC(=O)C)CC74)CC3)C%10%11C2OC%12OC%11(O)C(O)C%13C(C)(C)CCCC%12%13C1%10)C

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Identifiers

InChI

InChI=1S/C44H56O14/c1-17(45)52-22-15-20-19-9-14-40(56-31(19)41-24(22)38-12-7-10-36(3,4)26(38)28(47)43(41,50)57-34(38)54-30(20)41)21-16-23(53-18(2)46)25-39-13-8-11-37(5,6)27(39)29(48)44(51)42(25,33(40)49)32(21)55-35(39)58-44/h20-30,32,34-35,47-48,50-51H,7-16H2,1-6H3

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InChIKey

WSLVTMUJVXHIIJ-UHFFFAOYSA-N

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PubChem CID

163058090

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

WSLVTMUJVXHIIJ-UHFFFAOYSA-N

(Q110202180)

(3-Acetyloxy-6',7',13,14-tetrahydroxy-9',9',16,16-tetramethyl-7-oxospiro[10,12-dioxahexacyclo[9.8.0.01,15.02,8.05,9.08,13]nonadecane-6,21'-3,5,22-trioxaheptacyclo[12.9.0.01,6.02,17.04,13.08,13.018,23]tricos-18(23)-ene]-15'-yl) acetate

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