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Home > Encyclopedia > (E)-3-Phenylpropenoic acid (1S)-1α,2α,9α,10β-tetrahydroxy-13-oxotaxa-4(20),11-diene-5α-yl ester

(E)-3-Phenylpropenoic acid (1S)-1α,2α,9α,10β-tetrahydroxy-13-oxotaxa-4(20),11-diene-5α-yl ester

(E)-3-Phenylpropenoic acid (1S)-1α,2α,9α,10β-tetrahydroxy-13-oxotaxa-4(20),11-diene-5α-yl ester structure

(E)-3-Phenylpropenoic acid (1S)-1α,2α,9α,10β-tetrahydroxy-13-oxotaxa-4(20),11-diene-5α-yl ester 

structure
  • CAS No:

    11034-45-0

  • Formula:

    C29H36O7

  • Chemical Name:

    (E)-3-Phenylpropenoic acid (1S)-1α,2α,9α,10β-tetrahydroxy-13-oxotaxa-4(20),11-diene-5α-yl ester

  • 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

(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

Characteristics

124

1.7

233-234°

D21 +285° (chloroform)

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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