Feedback

Lithothamnin A

Properties

Image

Occurences in reactions

MNX_ID

MNXM106254

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

formula

C₃₄H₂₇Br₅N₄O₁₀

charge

mass

1045.7644

reference

chebi:68053

InChIKey

ZFSTWMBDMZIGJR-GXABEWBWSA-N

InChI

InChI=1S/C34H27Br5N4O10/c35-18-10-16-2-4-41-34(49)23(43-51)11-17-25(45)12-21(38)32(29(17)39)53-28-9-15(6-20(37)31(28)47)7-22(42-50)33(48)40-3-1-14-5-19(36)30(46)27(8-14)52-26(18)13-24(16)44/h5-6,8-10,12-13,44-47,50-51H,1-4,7,11H2,(H,40,48)(H,41,49)/b42-22+,43-23+

SMILES

O=C1NCCc2cc(Br)c(O)c(c2)Oc2cc(O)c(cc2Br)CCNC(=O)/C(=N/O)Cc2c(O)cc(Br)c(c2Br)Oc2cc(cc(Br)c2O)C/C1=N\O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:68053 chebi:68053	Lithothamnin A (12E,26E)-5,16,21,34,36-Pentabromo-4,17,23,32-tetrahydroxy-12,26-bis(hydroxyimino)-2,19-dioxa-10,28-diazapentacyclo[29.2.2.1[3,7].1[14,18].1[20,24]]octatriaconta-1(33),3(38),4,6,14(37),15,17,20(36),21 ,23,31,34-dodecaene-11,27-dione