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Spirolide C

Properties

Image

Occurences in reactions

MNX_ID

MNXM130879

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

formula

C₄₃H₆₃NO₇

charge

mass

705.46045

reference

hmdb:HMDB0038344

InChIKey

BDNZANPABAQRBQ-LGUFXXKBSA-N

InChI

InChI=1S/C43H63NO7/c1-25-10-9-11-38-41(22-28(4)30(6)24-44-38)15-13-33(37-20-27(3)39(46)48-37)31(7)34(41)19-26(2)35(45)21-36-29(5)23-42(50-36)16-17-43(51-42)40(8,47)14-12-32(18-25)49-43/h19-20,28-30,32,34-37,45,47H,1,9-18,21-24H2,2-8H3/b26-19+

SMILES

C=C1CCCC2=NCC(C)C(C)CC23CCC(C2C=C(C)C(=O)O2)=C(C)C3/C=C(\C)C(O)CC2OC3(CCC4(OC(CCC4(C)O)C1)O3)CC2C

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
hmdb:HMDB0038344	Spirolide C 5-[(10E)-9,32-dihydroxy-6,10,13,19,20,32-hexamethyl-27-methylidene-33,34,35-trioxa-22-azahexacyclo[27.3.1.1¹,⁴.1⁴,⁷.0¹²,¹⁷.0¹⁷,²³]pentatriaconta-10,13,22-trien-14-yl]-3-methyl-2,5-dihydrofuran-2-one 5-[(10E)-9,32-dihydroxy-6,10,13,19,20,32-hexamethyl-27-methylidene-33,34,35-trioxa-22-azahexacyclo[27.3.1.1¹,⁴.1⁴,⁷.0¹²,¹⁷.0¹⁷,²³]pentatriaconta-10,13,22-trien-14-yl]-3-methyl-5H-furan-2-one
hmdb:HMDB38344	secondary/obsolete/fantasy identifier