alpha-Collatolic acid
Molecular Formula:
C29H34O9
InChI: InChI=1/C29H34O9/c1-4-6-8-10-18(30)12-17-13-20(36-3)15-23-25(17)29(35)38-24-16-22(32)26(28(33)34)21(27(24)37-23)14-19(31)11-9-7-5-2/h13,15-16,32H,4-12,14H2,1-3H3,(H,33,34)/f/h33H
InChIKey: InChIKey=QLTNFHFQLMFRBN-NSJMMFDCCY
SMILES: CCCCCC(=O)CC1=CC(=CC2=C1C(=O)OC3=CC(=C(C(=C3O2)CC(=O)CCCCC)C(=O)O)O)OC
Names:
alpha-Collatolic acid
BRN 0376916
Collatolic acid-A''
11H-Dibenzo(b,e)(1,4)dioxepin-7-carboxylic acid, 8-hydroxy-3-methoxy-11-oxo-1,6-bis(2-oxoheptyl)-
11H-DIBENZO(b,e)(1,4)DIOXEPIN-7-CARBOXYLIC ACID, 8-HYDROXY-3-METHOXY-11-OXO-1,6-
4-19-00-04004 (Beilstein Handbook Reference)
522-52-1
Registries:
PubChem CID 10650
PubChem ID 153951
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