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Goyaglycoside a

Properties

Image

Occurences in reactions

MNX_ID

MNXM126287

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₃₇H₆₀O₉

charge

mass

648.42373

reference

chebi:176277

InChIKey

VTWHHBJKZZJDQM-OQLLNIDSSA-N

InChI

InChI=1S/C37H60O9/c1-21(10-9-15-32(2,3)42)22-13-16-35(7)24-14-17-37-25(36(24,31(43-8)46-37)19-18-34(22,35)6)11-12-26(33(37,4)5)45-30-29(41)28(40)27(39)23(20-38)44-30/h9,14-15,17,21-31,38-42H,10-13,16,18-20H2,1-8H3/b15-9+

SMILES

COC1OC23C=CC4C1(CCC1(C)C(C(C)C/C=C/C(C)(C)O)CCC41C)C2CCC(OC1OC(CO)C(O)C(O)C1O)C3(C)C

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:176277 chebi:176277	Goyaglycoside a 2-(hydroxymethyl)-6-[[8-[(E)-6-hydroxy-6-methylhept-4-en-2-yl]-19-methoxy-5,9,17,17-tetramethyl-18-oxapentacyclo[10.5.2.01,13.04,12.05,9]nonadec-2-en-16-yl]oxy]oxane-3,4,5-triol
hmdb:HMDB0038348	Goyaglycoside a 2-({8-[(4E)-6-hydroxy-6-methylhept-4-en-2-yl]-19-methoxy-5,9,17,17-tetramethyl-18-oxapentacyclo[10.5.2.0¹,¹³.0⁴,¹².0⁵,⁹]nonadec-2-en-16-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triol
hmdb:HMDB38348	secondary/obsolete/fantasy identifier