Stachybotrin A triacetate

SpectraBase Compound ID	88J3ntrroc8
InChI	InChI=1S/C29H37NO8/c1-17(2)9-7-10-21(16-35-18(3)31)11-8-12-29(6)26(37-20(5)33)14-23-25(36-19(4)32)13-22-24(27(23)38-29)15-30-28(22)34/h9,11,13,26H,7-8,10,12,14-16H2,1-6H3,(H,30,34)/b21-11-/t26-,29-/m0/s1
InChIKey	OMILRWCSAQRYGZ-TTYMVASISA-N Google Search
Mol Weight	527.6 g/mol
Molecular Formula	C29H37NO8
Exact Mass	527.251917 g/mol

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SpectraBase Spectrum ID	4y6vpOaa1Qx
Name	Stachybotrin A triacetate
Copyright	Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C29H37NO8
InChI	InChI=1S/C29H37NO8/c1-17(2)9-7-10-21(16-35-18(3)31)11-8-12-29(6)26(37-20(5)33)14-23-25(36-19(4)32)13-22-24(27(23)38-29)15-30-28(22)34/h9,11,13,26H,7-8,10,12,14-16H2,1-6H3,(H,30,34)/b21-11-/t26-,29-/m0/s1
InChIKey	OMILRWCSAQRYGZ-TTYMVASISA-N
Molecular Weight	527.614 g/mol
SMILES	N1C(c2cc(c3c(c2C1)O[C@]([C@](C3)(OC(=O)C)[H])(CC\C=C/(COC(=O)C)CCC=C(C)C)C)OC(=O)C)=O
SPLASH	splash10-0006-9020000000-3f4ce213a261c1cb8af2
Source of Spectrum	J-57-6702-0
Synonyms	(2S)-3-(acetyloxy)-2-{(3Z)-4-[(acetyloxy)methyl]-8-methyl-3,7-nonadienyl}-2-methyl-7-oxo-2,3,4,7,8,9-hexahydropyrano[2,3-e]isoindol-5-yl acetate Acetic acid (2S,3S)-3-acetoxy-2-((Z)-4-acetoxymethyl-8-methyl-nona-3,7-dienyl)-2-methyl-7-oxo-2,3,4,7,8,9-hexahydro-pyrano[2,3-e]isoindol-5-yl ester Acetic acid [(2Z)-2-[3-[(2S,3S)-3,5-diacetyloxy-2-methyl-7-oxo-3,4,8,9-tetrahydropyrano[2,3-e]isoindol-2-yl]propylidene]-6-methylhept-5-enyl] ester [(2Z)-2-[3-[(2S,3S)-3,5-diacetyloxy-2-methyl-7-oxo-3,4,8,9-tetrahydropyrano[2,3-e]isoindol-2-yl]propylidene]-6-methylhept-5-enyl] acetate [(2Z)-2-[3-[(2S,3S)-3,5-diacetoxy-2-methyl-7-oxo-3,4,8,9-tetrahydropyrano[2,3-e]isoindol-2-yl]propylidene]-6-methyl-hept-5-enyl] acetate [(2Z)-2-[3-[(2S,3S)-3,5-diacetyloxy-2-methyl-7-oxidanylidene-3,4,8,9-tetrahydropyrano[2,3-e]isoindol-2-yl]propylidene]-6-methyl-hept-5-enyl] ethanoate
Wiley ID	1402962