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Capsochrome

Properties

Image

Occurences in reactions

MNX_ID

MNXM120178

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

formula

C₄₀H₅₆O₄

charge

mass

600.41786

reference

hmdb:HMDB0036913

InChIKey

PLVBBQBJTBWTDY-XGNSBGGRSA-N

InChI

InChI=1S/C40H56O4/c1-28(15-11-12-20-31(4)34-23-35-37(5,6)24-32(41)27-40(35,10)44-34)16-13-17-29(2)18-14-19-30(3)21-22-36(43)39(9)26-33(42)25-38(39,7)8/h11-23,32-34,41-42H,24-27H2,1-10H3/b12-11+,16-13-,18-14-,22-21+,28-15+,29-17+,30-19-,31-20-

SMILES

CC(=C/C=C\C(C)=C\C=C/C(C)=C/C=C/C=C(/C)C1C=C2C(C)(C)CC(O)CC2(C)O1)/C=C/C(=O)C1(C)CC(O)CC1(C)C

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
hmdb:HMDB0036913	Capsochrome (2E,4Z,6Z,8E,10Z,12E,14E,16Z)-1-(4-hydroxy-1,2,2-trimethylcyclopentyl)-17-(6-hydroxy-4,4,7a-trimethyl-2,4,5,6,7,7a-hexahydro-1-benzofuran-2-yl)-4,8,12-trimethyloctadeca-2,4,6,8,10,12,14,16-octaen-1-one (2E,4Z,6Z,8E,10Z,12E,14E,16Z)-1-(4-hydroxy-1,2,2-trimethylcyclopentyl)-17-(6-hydroxy-4,4,7a-trimethyl-2,5,6,7-tetrahydro-1-benzofuran-2-yl)-4,8,12-trimethyloctadeca-2,4,6,8,10,12,14,16-octaen-1-one 5,8-Epoxy-5,8-dihydro-3,3'-dihydroxy-b,K-caroten-6'-one
hmdb:HMDB36913	secondary/obsolete/fantasy identifier