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Gossypol

MNXM8688 is deprecated and here replaced by MNXM1108525
!!! Alternative mappings exist !!!

Properties

Image

Occurences in reactions

MNX_ID

MNXM1108525

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	0

formula

C₃₀H₃₀O₈

charge

mass

518.19407

reference

keggC:C07667

InChIKey

QBKSWRVVCFFDOT-UHFFFAOYSA-N

InChI

InChI=1S/C30H30O8/c1-11(2)19-15-7-13(5)21(27(35)23(15)17(9-31)25(33)29(19)37)22-14(6)8-16-20(12(3)4)30(38)26(34)18(10-32)24(16)28(22)36/h7-12,33-38H,1-6H3

SMILES

Cc1cc2c(C(C)C)c(O)c(O)c(C=O)c2c(O)c1-c1c(C)cc2c(C(C)C)c(O)c(O)c(C=O)c2c1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
kegg.compound:C07667 keggC:C07667 lipidmaps:LMPR0103330002 lipidmapsM:LMPR0103330002	Gossypol
hmdb:HMDB0040723	(-)-Gossypol (+)-Gossypol (+-)-Gossypol (+/-)-gossypol (-)-gossypol (R)-(-)-Gossypol (R)-Gossypol 7-[8-formyl-1,6,7-trihydroxy-3-methyl-5-(propan-2-yl)naphthalen-2-yl]-2,3,8-trihydroxy-6-methyl-4-(propan-2-yl)naphthalene-1-carbaldehyde Dipotassium salt, gossypol Gossypol Gossypol dipotassium salt Gossypol from cotton seeds Gossypol sodium salt Gossypol, (+)-isomer Gossypol, (+-)-isomer Gossypol, (-)-isomer Pogosin Racemic-gossypol Sodium salt, gossypol Tash 1
metacyc.compound:CPD-9526 metacycM:CPD-9526	gossypol
hmdb:HMDB40723 keggC:M_C07667	secondary/obsolete/fantasy identifier