Structure

Concanamycin c

CAS
81552-34-3
Catalog Number
ACM81552343
Category
Other Products
Molecular Weight
823.06
Molecular Formula
C45H74O13

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Specification

Synonyms
Concanamycin C, 4-O-De(aminocarbonyl)concanamycin A, Concanamycin A, 4-O-de(aminocarbonyl)-, CID6441954, LS-54754, 81552-34-3
IUPAC Name
(3E,5Z,13Z,15Z)-18-[4-[4-[(2S,4R,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-2-hydroxy-5-methyl-6-[(E)-prop-1-enyl]oxan-2-yl]-3-hydroxypentan-2-yl]-9-ethyl-8,10-dihydroxy-3,17-dimethoxy-5,7,11,13-tetramethyl-1-oxacyclooctadeca-3,5,13,15-tetraen-2-one
Canonical SMILES
CCC1C(C(CC(=CC=CC(C(OC(=O)C(=CC(=CC(C1O)C)C)OC)C(C)C(C(C)C2(CC(C(C(O2)C=CC)C)OC3CC(C(C(O3)C)O)O)O)O)OC)C)C)O
InChI Key
XKYYLWWOGLVPOR-MRFBZEJSSA-N
Boiling Point
914.2ºC at 760 mmHg
Flash Point
259.8ºC
Density
1.18g/cm³
Exact Mass
822.51300
Hazard Statements
T+
H-Bond Acceptor
13
H-Bond Donor
6
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