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interiotherin A

Properties

Image

Occurences in reactions

MNX_ID

MNXM105750

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

formula

C₂₉H₂₈O₈

charge

mass

504.17842

reference

chebi:66082

InChIKey

MBGKPRSARHEFAG-CCHLGUQTSA-N

InChI

InChI=1S/C29H28O8/c1-15-10-18-11-20-25(35-13-33-20)27(31-3)22(18)23-19(12-21-26(28(23)32-4)36-14-34-21)24(16(15)2)37-29(30)17-8-6-5-7-9-17/h5-9,11-12,15-16,24H,10,13-14H2,1-4H3/t15-,16-,24+/m0/s1

SMILES

COc1c2c(cc3c1-c1c(cc4c(c1OC)OCO4)[C@H](OC(=O)c1ccccc1)[C@@H](C)[C@@H](C)C3)OCO2

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Similar chemical compounds in external resources
Identifier	Description
CHEBI:66082 chebi:66082	interiotherin A (-)-interiotherin A Cycloocta(1,2-f:3,4-f')bis(1,3)benzodioxol-5-ol, 5,6,7,8-tetrahydro-13,14-dimethoxy-6,7-dimethyl-, benzoate(5R,6S,7S,13aS)