(E)-3-Phenylpropenoic acid (1S)-1α,2α,9α,10β-tetrahydroxy-13-oxotaxa-4(20),11-diene-5α-yl ester
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(E)-3-Phenylpropenoic acid (1S)-1α,2α,9α,10β-tetrahydroxy-13-oxotaxa-4(20),11-diene-5α-yl ester
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CAS No:
11034-45-0
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Formula:
C29H36O7
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Chemical Name:
(E)-3-Phenylpropenoic acid (1S)-1α,2α,9α,10β-tetrahydroxy-13-oxotaxa-4(20),11-diene-5α-yl ester
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Synonyms:
(+)-O-Cinnamoyltaxicin I;(1S)-5α-Cinnamoyloxy-1,2α,9α,10β-tetrahydroxytaxa-4(20),11-dien-13-one;(1S,2S,5S,9R,10R)-1,2,9,10-Tetrahydroxy-5α-(cinnamoyloxy)-13-oxotaxa-4(20),11-diene;(E)-3-Phenylpropenoic acid (1S)-1α,2α,9α,10β-tetrahydroxy-13-oxotaxa-4(20),11-diene-5α-yl ester;O-Cinnamoyl taxicin I
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CAS No:
(E)-3-Phenylpropenoic acid (1S)-1α,2α,9α,10β-tetrahydroxy-13-oxotaxa-4(20),11-diene-5α-yl ester Basic Attributes
496.59194
496.246
7IR97P1VXE
Computed Properties
Molecular Weight:496.6
XLogP3:1.7
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:496.24610348
Monoisotopic Mass:496.24610348
Topological Polar Surface Area:124
Heavy Atom Count:36
Complexity:988
Defined Atom Stereocenter Count:7
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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(E)-3-Phenylpropenoic acid (1S)-1α,2α,9α,10β-tetrahydroxy-13-oxotaxa-4(20),11-diene-5α-yl ester
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