Home Other Heterocycles 384832-91-1
384832-91-1
Catalog No.:AA01EQ8K

384832-91-1 | 9Z-octadecenoicacid,1,1'-[(1R)-1-[8-(3',6'-dihydroxy-3-oxospiro[isobenzofuran-1(3H),9'-[9H]xanthen]-5-yl)-3-hydroxy-3-oxido-8-oxo-2,4-dioxa-7-aza-3-phosphaoct-1-yl]-1,2-ethanediyl]ester,diammoniumsalt

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Technical Information
Catalog Number:
AA01EQ8K
Chemical Name:
9Z-octadecenoicacid,1,1'-[(1R)-1-[8-(3',6'-dihydroxy-3-oxospiro[isobenzofuran-1(3H),9'-[9H]xanthen]-5-yl)-3-hydroxy-3-oxido-8-oxo-2,4-dioxa-7-aza-3-phosphaoct-1-yl]-1,2-ethanediyl]ester,diammoniumsalt
CAS Number:
384832-91-1
Molecular Formula:
C62H94N3O14P
Molecular Weight:
1136.3952
SMILES:
CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@@H](OC(=O)CCCCCCC/C=C\CCCCCCCC)COP(=O)(OCCNC(=O)c1ccc2c(c1)C(=O)OC12c2ccc(cc2Oc2c1ccc(c2)O)O)O.N.N
Properties
Computed Properties
 
Complexity:
1800  
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
2  
Heavy Atom Count:
80  
Hydrogen Bond Acceptor Count:
16  
Hydrogen Bond Donor Count:
6  
Rotatable Bond Count:
43  

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SDS
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Tags:384832-91-1 Molecular Formula|384832-91-1 MDL|384832-91-1 SMILES|384832-91-1 9Z-octadecenoicacid,1,1'-[(1R)-1-[8-(3',6'-dihydroxy-3-oxospiro[isobenzofuran-1(3H),9'-[9H]xanthen]-5-yl)-3-hydroxy-3-oxido-8-oxo-2,4-dioxa-7-aza-3-phosphaoct-1-yl]-1,2-ethanediyl]ester,diammoniumsalt