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goniodomin A

goniodomin A structure

CAS No:
112923-40-7
Formula:
C43H60O12
Chemical Name:
goniodomin A
Synonyms:
22,33,34,35,36,37-Hexaoxahexacyclo[27.3.1.11,5.16,10.111,14.124,28]heptatriaconta-8,19-dien-23-one,16,17,27-trihydroxy-31-methyl-2,15,25,30-tetrakis(methylene)-21-[(2R,3R,4S)-tetrahydro-2-hydroxy-3,4-dimethyl-2H-pyran-2-yl]-,(1S,5S,6S,10R,11S,14S,16R,17R,19Z,21S,24R,27S,28S,29R,31R)-;(1S,5S,6S,10R,11S,14S,16R,17R,19Z,21S,24R,27S,28S,29R,31R)-16,17,27-Trihydroxy-31-methyl-2,15,25,30-tetrakis(methylene)-21-[(2R,3R,4S)-tetrahydro-2-hydroxy-3,4-dimethyl-2H-pyran-2-yl]-22,33,34,35,36,37-hexaoxahexacyclo[27.3.1.11,5.16,10.111,14.124,28]heptatriaconta-8,19-dien-23-one;Goniodomin A;(+)-Goniodomin A
Categories:
Organic Chemistry > Lactones

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goniodomin A Basic Attributes

Molecular Weight：

768.92900

Exact Mass：

768.93

Characteristics

PSA：

162.60000

XLogP3：

4.26580

Density：

1.28g/cm3

Boiling Point：

891.4ºC at 760 mmHg

Flash Point：

264.1ºC

Refractive Index：

1.591

Vapor Pressure：

0mmHg at 25°C

Drug Information

MeSH Entry Terms：

goniodomin A

Computed Properties

Molecular Weight:768.9
XLogP3:2.8
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:1
Exact Mass:768.40847734
Monoisotopic Mass:768.40847734
Topological Polar Surface Area:163
Heavy Atom Count:55
Complexity:1570
Undefined Atom Stereocenter Count:17
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes